Chemical identity

N-Nitroso-desmethyl Trimebutine

CAS not listed · C21H26N2O6

01Identity

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

Lazychem IDLC-32236
PubChem CID169446863
NameN-Nitroso-desmethyl Trimebutine
CAS RNNot listed
Molecular formulaC21H26N2O6
Molecular weight402.44 g/mol
IUPAC name2-(Methyl(nitroso)amino)-2-phenylbutyl 3, 4, 5-trimethoxybenzoate
InChIKeyYUOYDBLRSYSQFI-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 169446863
Two-dimensional chemical structure of N-Nitroso-desmethyl Trimebutine
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon, contains an N-nitroso substructure. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres1
Ring count2
Secondary amines0
Tertiary amines1
N-methyl amine sites1
SMILESO=C(OCC(C1=CC=CC=C1)(N(C)N=O)CC)C2=CC(OC)=C(OC)C(OC)=C2
InChINot listed
Formula from structureC21H26N2O6
Molecular weight from structure402.44 g/mol

03Stereochemistry

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

Defined centres0Structure assigned
Unassigned centres1Structure unspecified
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 / RCSNO EXACT MATCH FOUNDNo CAS number is available for an exact comparison.
SCOMETNO EXACT REVIEWED CAS MATCHNo CAS number is available for an exact comparison.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

05Names and relationships

Associated parent compound

Trimebutine

View API and impurity family

Other names

  • N-Nitroso Trimebutine EP Impurity E

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