methyl (12Z,15Z)-13-bromanyl-9-oxidanylidene-octadeca-12,15-dienoate

Systemtic Name: methyl (12Z,15Z)-13-bromanyl-9-oxidanylidene-octadeca-12,15-dienoate Openeye Name: methyl (12Z,15Z)-13-bromo-9-oxo-octadeca-12,15-dienoate CAS Name: (12Z,15Z)-13-bromo-9-oxooctadeca-12,15-dienoic acid methyl ester IUPAC Name: methyl (12Z,15Z)-13-bromo-9-oxooctadeca-12,15-dienoate Traditional Name: (12Z,15Z)-13-bromo-9-keto-octadeca-12,15-dienoic acid methyl ester Formula: C19H31BrO3 MolecularWeight: 387.35164

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(=CCCC(=O)CCCCCCCC(=O)OC)Br

Isomeric SMILES

CC/C=C\C/C(=C/CCC(=O)CCCCCCCC(=O)OC)/Br

InChI

InChI=1S/C19H31BrO3/c1-3-4-8-12-17(20)13-11-15-18(21)14-9-6-5-7-10-16-19(22)23-2/h4,8,13H,3,5-7,9-12,14-16H2,1-2H3/b8-4-,17-13-