3-Pyrrolidinecarboxylic acid, 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-, ethyl ester, (2?,3?,4?)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H23NO5
Molecular Weight	369.411
Optical Activity	( + / - )
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Pyrrolidinecarboxylic acid, 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-, ethyl ester, (2?,3?,4?)-

Structure Search

SMILES

CCOC(=O)[C@H]1[C@H](CN[C@@H]1C2=CC=C(OC)C=C2)C3=CC4=C(OCO4)C=C3

InChI

InChIKey=SUCOGDSEXBRYSF-LSTHTHJFSA-N

InChI=1S/C21H23NO5/c1-3-25-21(23)19-16(14-6-9-17-18(10-14)27-12-26-17)11-22-20(19)13-4-7-15(24-2)8-5-13/h4-10,16,19-20,22H,3,11-12H2,1-2H3/t16-,19+,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H23NO5
Molecular Weight	369.411
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:05:38 GMT 2025` Edited by `admin` on `Wed Apr 02 19:05:38 GMT 2025`
Record UNII	29Y9ZYZ4TB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Pyrrolidinecarboxylic acid, 4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-, ethyl ester, (2?,3?,4?)-

Preferred Name

English

Code System Code Type Description

PUBCHEM

54324739

Created by admin on Wed Apr 02 19:05:38 GMT 2025 , Edited by admin on Wed Apr 02 19:05:38 GMT 2025

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CAS

173937-95-6

Created by admin on Wed Apr 02 19:05:38 GMT 2025 , Edited by admin on Wed Apr 02 19:05:38 GMT 2025

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FDA UNII

29Y9ZYZ4TB

Created by admin on Wed Apr 02 19:05:38 GMT 2025 , Edited by admin on Wed Apr 02 19:05:38 GMT 2025

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