2-[(E)-octadec-9-enyl]benzoate

Systemtic Name: 2-[(E)-octadec-9-enyl]benzoate Openeye Name: 2-[(E)-octadec-9-enyl]benzoate CAS Name: 2-[(E)-octadec-9-enyl]benzoate IUPAC Name: 2-[(E)-octadec-9-enyl]benzoate Traditional Name: 2-[(E)-octadec-9-enyl]benzoate Formula: C25H39O2- MolecularWeight: 371.57596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C25H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-21-18-19-22-24(23)25(26)27/h9-10,18-19,21-22H,2-8,11-17,20H2,1H3,(H,26,27)/p-1/b10-9+