dimethyl (E)-3-methoxy-4-oxidanylidene-5-[(8Z,11Z)-pentadeca-8,11,14-trienyl]hex-2-enedioate

Systemtic Name: dimethyl (E)-3-methoxy-4-oxidanylidene-5-[(8Z,11Z)-pentadeca-8,11,14-trienyl]hex-2-enedioate Openeye Name: dimethyl (E)-3-methoxy-4-oxo-5-[(8Z,11Z)-pentadeca-8,11,14-trienyl]hex-2-enedioate CAS Name: (E)-3-methoxy-4-oxo-5-[(8Z,11Z)-pentadeca-8,11,14-trienyl]-2-hexenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-3-methoxy-4-oxo-5-[(8Z,11Z)-pentadeca-8,11,14-trienyl]hex-2-enedioate Traditional Name: (E)-4-keto-3-methoxy-5-[(8Z,11Z)-pentadeca-8,11,14-trienyl]hex-2-enedioic acid dimethyl ester Formula: C24H36O6 MolecularWeight: 420.53904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=CC(=O)OC)C(=O)C(CCCCCCCC=CCC=CCC=C)C(=O)OC

Isomeric SMILES

CO/C(=C/C(=O)OC)/C(=O)C(CCCCCCC/C=C\C/C=C\CC=C)C(=O)OC

InChI

InChI=1S/C24H36O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(24(27)30-4)23(26)21(28-2)19-22(25)29-3/h5,7-8,10-11,19-20H,1,6,9,12-18H2,2-4H3/b8-7-,11-10-,21-19+