3-oxidanylidenebutanoyl (E)-octadec-9-enoate

Systemtic Name: 3-oxidanylidenebutanoyl (E)-octadec-9-enoate Openeye Name: 3-oxobutanoyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid 1,3-dioxobutyl ester IUPAC Name: 3-oxobutanoyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid acetoacetyl ester Formula: C22H38O4 MolecularWeight: 366.53472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(=O)CC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C22H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(24)26-22(25)19-20(2)23/h10-11H,3-9,12-19H2,1-2H3/b11-10+