Ethyl (2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylate

Details

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

SHOW SMILES / InChI

Structure of Ethyl (2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylate

Structure Search

SMILES

CCOC(=O)[C@H]1[C@@H](CN[C@@H]1C2=CC=C(OC)C=C2)C3=CC=C4OCOC4=C3

InChI

InChIKey=SUCOGDSEXBRYSF-FFZOFVMBSA-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+/m0/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 21:07:14 GMT 2025` Edited by `admin` on `Wed Apr 02 21:07:14 GMT 2025`
Record UNII	2293FYC2PW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Ethyl (2S,3S,4R)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylate

Systematic Name

English

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

Preferred Name

English

Code System Code Type Description

FDA UNII

2293FYC2PW

Created by admin on Wed Apr 02 21:07:14 GMT 2025 , Edited by admin on Wed Apr 02 21:07:14 GMT 2025

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PUBCHEM

101336780

Created by admin on Wed Apr 02 21:07:14 GMT 2025 , Edited by admin on Wed Apr 02 21:07:14 GMT 2025

PRIMARY

CAS

403614-48-2

Created by admin on Wed Apr 02 21:07:14 GMT 2025 , Edited by admin on Wed Apr 02 21:07:14 GMT 2025

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Ethyl (2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-3-pyrrolidinecarboxylate

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