Chemical identity

4-(Ethyl(1-(4-methoxyphenyl)propan-2-yl)amino)butyl acetate

CAS 373385-74-1 · C18H29NO3

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-02898
PubChem CID175678831
Name4-(Ethyl(1-(4-methoxyphenyl)propan-2-yl)amino)butyl acetate
CAS RN373385-74-1
Molecular formulaC18H29NO3
Molecular weight307.43 g/mol
IUPAC name4-(Ethyl(1-(4-methoxyphenyl)propan-2-yl)amino)butyl acetate
InChIKeyCDAVTRJNMGJERG-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 175678831
2D structure: 4-(Ethyl(1-(4-methoxyphenyl)propan-2-yl)amino)butyl acetate, CAS 373385-74-1
Structure of 4-(Ethyl(1-(4-methoxyphenyl)propan-2-yl)amino)butyl acetate (CAS 373385-74-1). LazyChem record. Source identity: PubChem CID 175678831. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC18H29NO3
InChIKeyCDAVTRJNMGJERG-UHFFFAOYSA-N
Ring count1
Defined stereocentres0
Unassigned stereocentres1
SMILESCC(OCCCCN(CC)C(C)CC1=CC=C(OC)C=C1)=O
InChIInChI=1S/C18H29NO3/c1-5-19(12-6-7-13-22-16(3)20)15(2)14-17-8-10-18(21-4)11-9-17/h8-11,15H,5-7,12-14H2,1-4H3

03Stereochemistry

The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge-and-dash depiction is shown above.

Defined stereocentres02D structure
Unassigned stereocentres12D structure
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 373385-74-1 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 373385-74-1 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Mebeverine

View API and impurity family

Other names

  • N-Ethyl-N-[1-(4-methoxyphenyl)propan-2-yl]amino]butyl acetate

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources