Ethyl (2R,3R,4S)-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 (2R,3R,4S)-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-AHRSYUTCSA-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

Approval Year

Name

Type

Language

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

Preferred Name

English

Ethyl (2R,3R,4S)-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, [2R-(2?,3?,4?)]-

Systematic Name

English

Ethyl (2R,3R,4S)-2-(4-Methoxyphenyl)-4-[3,4-(methylenedioxy)phenyl]pyrrolidine-3-carboxylate

Systematic Name

English

Code System Code Type Description

CAS

178739-03-2

Created by admin on Wed Apr 02 19:42:20 GMT 2025 , Edited by admin on Wed Apr 02 19:42:20 GMT 2025

PRIMARY

PUBCHEM

10785319

Created by admin on Wed Apr 02 19:42:20 GMT 2025 , Edited by admin on Wed Apr 02 19:42:20 GMT 2025

PRIMARY

FDA UNII

6Y3GWY3BLG

Created by admin on Wed Apr 02 19:42:20 GMT 2025 , Edited by admin on Wed Apr 02 19:42:20 GMT 2025

PRIMARY

SALT/SOLVATE (PARENT)


					H7H9DV8DZ6

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

SUBSTANCE RECORD


					6Y3GWY3BLG

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