methyl (9S,10E,12Z)-9-oxidanyloctadeca-10,12-dienoate

Systemtic Name: methyl (9S,10E,12Z)-9-oxidanyloctadeca-10,12-dienoate Openeye Name: methyl (9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoate CAS Name: (9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid methyl ester IUPAC Name: methyl (9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoate Traditional Name: (9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid methyl ester Formula: C19H34O3 MolecularWeight: 310.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC=CC(CCCCCCCC(=O)OC)O

Isomeric SMILES

CCCCC/C=C\C=C\[C@H](CCCCCCCC(=O)OC)O

InChI

InChI=1S/C19H34O3/c1-3-4-5-6-7-9-12-15-18(20)16-13-10-8-11-14-17-19(21)22-2/h7,9,12,15,18,20H,3-6,8,10-11,13-14,16-17H2,1-2H3/b9-7-,15-12+/t18-/m1/s1