[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl] (9Z,12Z)-18-oxidanyloctadeca-9,12-dienoate

Systemtic Name: [(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl] (9Z,12Z)-18-oxidanyloctadeca-9,12-dienoate Openeye Name: [(E)-3-(3,4-dimethoxyphenyl)allyl] (9Z,12Z)-18-hydroxyoctadeca-9,12-dienoate CAS Name: (9Z,12Z)-18-hydroxyoctadeca-9,12-dienoic acid [(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl] ester IUPAC Name: [(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl] (9Z,12Z)-18-hydroxyoctadeca-9,12-dienoate Traditional Name: (9Z,12Z)-18-hydroxyoctadeca-9,12-dienoic acid [(E)-3-(3,4-dimethoxyphenyl)allyl] ester Formula: C29H44O5 MolecularWeight: 472.65666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CCOC(=O)CCCCCCCC=CCC=CCCCCCO)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/COC(=O)CCCCCCC/C=C\C/C=C\CCCCCO)OC

InChI

InChI=1S/C29H44O5/c1-32-27-22-21-26(25-28(27)33-2)19-18-24-34-29(31)20-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-23-30/h3-4,7,9,18-19,21-22,25,30H,5-6,8,10-17,20,23-24H2,1-2H3/b4-3-,9-7-,19-18+