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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H12O2
Molecular Weight 188.2225
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-BUTYLIDENEPHTHALIDE, (Z)-

SMILES

CCC\C=C1/OC(=O)C2=C1C=CC=C2

InChI

InChIKey=WMBOCUXXNSOQHM-FLIBITNWSA-N
InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8-

HIDE SMILES / InChI

Approval Year