U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C31H34N2O3
Molecular Weight 482.6133
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[2-(3-tert-Butyl-4-pyrrolidin-1-ylphenyl)-4-(4-cyanophenyl)phenoxy]ethyl acetate

SMILES

CC(=O)OCCOC1=CC=C(C=C1C2=CC=C(N3CCCC3)C(=C2)C(C)(C)C)C4=CC=C(C=C4)C#N

InChI

InChIKey=YXBZZWJPJUDLSU-UHFFFAOYSA-N
InChI=1S/C31H34N2O3/c1-22(34)35-17-18-36-30-14-12-25(24-9-7-23(21-32)8-10-24)19-27(30)26-11-13-29(33-15-5-6-16-33)28(20-26)31(2,3)4/h7-14,19-20H,5-6,15-18H2,1-4H3

HIDE SMILES / InChI

Approval Year

Name Type Language
2-[2-(3-tert-Butyl-4-pyrrolidin-1-ylphenyl)-4-(4-cyanophenyl)phenoxy]ethyl acetate
Preferred Name English
Code System Code Type Description
PUBCHEM
167352029
Created by admin on Wed Apr 02 17:56:27 GMT 2025 , Edited by admin on Wed Apr 02 17:56:27 GMT 2025
PRIMARY
FDA UNII
BYQ5V33QPK
Created by admin on Wed Apr 02 17:56:27 GMT 2025 , Edited by admin on Wed Apr 02 17:56:27 GMT 2025
PRIMARY
CAS
2649362-82-1
Created by admin on Wed Apr 02 17:56:27 GMT 2025 , Edited by admin on Wed Apr 02 17:56:27 GMT 2025
PRIMARY