[(E)-octadec-9-enoyl] benzoate

Systemtic Name: [(E)-octadec-9-enoyl] benzoate Openeye Name: [(E)-octadec-9-enoyl] benzoate CAS Name: benzoic acid [(E)-1-oxooctadec-9-enyl] ester IUPAC Name: [(E)-octadec-9-enoyl] benzoate Traditional Name: benzoic acid [(E)-octadec-9-enoyl] ester Formula: C25H38O3 MolecularWeight: 386.56742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C25H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-24(26)28-25(27)23-20-17-16-18-21-23/h9-10,16-18,20-21H,2-8,11-15,19,22H2,1H3/b10-9+