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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H19O2.Na
Molecular Weight 242.2892
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTIBUFEN SODIUM, (S)-

SMILES

[Na+].CC[C@H](C([O-])=O)C1=CC=C(CC(C)C)C=C1

InChI

InChIKey=SJBWJHOBCVAGGD-ZOWNYOTGSA-M
InChI=1S/C14H20O2.Na/c1-4-13(14(15)16)12-7-5-11(6-8-12)9-10(2)3;/h5-8,10,13H,4,9H2,1-3H3,(H,15,16);/q;+1/p-1/t13-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
BUTIBUFEN SODIUM, (S)-
Common Name English
BENZENEACETIC ACID, .ALPHA.-ETHYL-4-(2-METHYLPROPYL)-, SODIUM SALT (1:1), (S)-
Preferred Name English
Code System Code Type Description
PUBCHEM
121491967
Created by admin on Mon Mar 31 23:38:20 GMT 2025 , Edited by admin on Mon Mar 31 23:38:20 GMT 2025
PRIMARY
FDA UNII
Y83Z98NFXO
Created by admin on Mon Mar 31 23:38:20 GMT 2025 , Edited by admin on Mon Mar 31 23:38:20 GMT 2025
PRIMARY