Tapatybė

(S)-Rolipram

Nenurodyta · C16H21NO3

01Tapatybė

Lazychem IDLC-113584
CAS RNNenurodyta
PubChem CID158758
Molecular formulaC16H21NO3
Molecular weight275.34 g/mol
IUPAC name(4S)-4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidin-2-one
InChIKeyHJORMJIFDVBMOB-GFCCVEGCSA-N

02Struktūra ir stereochemija

2D structurePubChem CID 158758
Two-dimensional chemical structure of (S)-Rolipram
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count3
Secondary amines0
Tertiary amines0
SMILESCOC1=C(C=C(C=C1)[C@@H]2CC(=O)NC2)OC3CCCC3
InChINenurodyta

03Stereochemistry

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

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

2 records

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.

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.

04Statusas Indijoje

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Pavadinimai ir ryšiai

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      06Šaltiniai