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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H12O2
Molecular Weight 128.169
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-HEPTENOIC ACID, (2E)-

SMILES

CCCC\C=C\C(O)=O

InChI

InChIKey=YURNCBVQZBJDAJ-AATRIKPKSA-N
InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h5-6H,2-4H2,1H3,(H,8,9)/b6-5+

HIDE SMILES / InChI

Approval Year

PubMed