(3S,4R)-1-(CIS-4-CYANO-4-PHENYLCYCLOHEXYL)-3-METHYL-4-PHENYLPIPERIDINE-4-CARBOXYLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H30N2O2
Molecular Weight	402.5286
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (3S,4R)-1-(CIS-4-CYANO-4-PHENYLCYCLOHEXYL)-3-METHYL-4-PHENYLPIPERIDINE-4-CARBOXYLIC ACID

Structure Search

SMILES

C[C@@H]1CN(CC[C@]1(C(O)=O)C2=CC=CC=C2)[C@H]3CC[C@](CC3)(C#N)C4=CC=CC=C4

InChI

InChIKey=SACWPKNNCWGCEU-ZZGBNDFWSA-N

InChI=1S/C26H30N2O2/c1-20-18-28(17-16-26(20,24(29)30)22-10-6-3-7-11-22)23-12-14-25(19-27,15-13-23)21-8-4-2-5-9-21/h2-11,20,23H,12-18H2,1H3,(H,29,30)/t20-,23-,25-,26-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H30N2O2
Molecular Weight	402.5286
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:45:41 UTC 2023` Edited by `admin` on `Sat Dec 16 14:45:41 UTC 2023`
Record UNII	8QWG35G8BH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(3S,4R)-1-(CIS-4-CYANO-4-PHENYLCYCLOHEXYL)-3-METHYL-4-PHENYLPIPERIDINE-4-CARBOXYLIC ACID

Systematic Name

English

LEVOCABASTINE HYDROCHLORIDE IMPURITY A [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

8QWG35G8BH

Created by admin on Sat Dec 16 14:45:41 UTC 2023 , Edited by admin on Sat Dec 16 14:45:41 UTC 2023

PRIMARY

Related Record Type Details


					124XMA6YEI

LEVOCABASTINE HYDROCHLORIDE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: