[(E)-octadec-9-enyl] 4-sulfanylidenebutanoate

Systemtic Name: [(E)-octadec-9-enyl] 4-sulfanylidenebutanoate Openeye Name: [(E)-octadec-9-enyl] 4-thioxobutanoate CAS Name: 4-sulfanylidenebutanoic acid [(E)-octadec-9-enyl] ester IUPAC Name: [(E)-octadec-9-enyl] 4-sulfanylidenebutanoate Traditional Name: 4-thioxobutyric acid [(E)-octadec-9-enyl] ester Formula: C22H40O2S MolecularWeight: 368.6168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC(=O)CCC=S

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOC(=O)CCC=S

InChI

InChI=1S/C22H40O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-22(23)19-18-21-25/h9-10,21H,2-8,11-20H2,1H3/b10-9+