[(10E,12E)-14-oxidanyl-18-phenyl-octadeca-10,12-dien-9-yl] ethanoate

Systemtic Name: [(10E,12E)-14-oxidanyl-18-phenyl-octadeca-10,12-dien-9-yl] ethanoate Openeye Name: [(2E,4E)-6-hydroxy-1-octyl-10-phenyl-deca-2,4-dienyl] acetate CAS Name: acetic acid [(10E,12E)-14-hydroxy-18-phenyloctadeca-10,12-dien-9-yl] ester IUPAC Name: [(10E,12E)-14-hydroxy-18-phenyloctadeca-10,12-dien-9-yl] acetate Traditional Name: acetic acid [(2E,4E)-6-hydroxy-1-octyl-10-phenyl-deca-2,4-dienyl] ester Formula: C26H40O3 MolecularWeight: 400.594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC=CC(CCCCC1=CC=CC=C1)O)OC(=O)C

Isomeric SMILES

CCCCCCCCC(/C=C/C=C/C(CCCCC1=CC=CC=C1)O)OC(=O)C

InChI

InChI=1S/C26H40O3/c1-3-4-5-6-7-11-21-26(29-23(2)27)22-15-14-20-25(28)19-13-12-18-24-16-9-8-10-17-24/h8-10,14-17,20,22,25-26,28H,3-7,11-13,18-19,21H2,1-2H3/b20-14+,22-15+