[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl] (9Z,12Z)-octadeca-9,12-dienoate

Systemtic Name: [(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl] (9Z,12Z)-octadeca-9,12-dienoate Openeye Name: [(E)-3-(4-hydroxy-3-methoxy-phenyl)allyl] (9Z,12Z)-octadeca-9,12-dienoate CAS Name: (9Z,12Z)-octadeca-9,12-dienoic acid [(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] ester IUPAC Name: [(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] (9Z,12Z)-octadeca-9,12-dienoate Traditional Name: (9Z,12Z)-octadeca-9,12-dienoic acid [(E)-3-(4-hydroxy-3-methoxy-phenyl)allyl] ester Formula: C28H42O4 MolecularWeight: 442.63068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)OCC=CC1=CC(=C(C=C1)O)OC

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC/C=C/C1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C28H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28(30)32-23-18-19-25-21-22-26(29)27(24-25)31-2/h7-8,10-11,18-19,21-22,24,29H,3-6,9,12-17,20,23H2,1-2H3/b8-7-,11-10-,19-18+