[(1E,3E)-1-[2-(5-oxidanylpentyl)phenyl]pentadeca-1,3-dien-5-yl] ethanoate

Systemtic Name: [(1E,3E)-1-[2-(5-oxidanylpentyl)phenyl]pentadeca-1,3-dien-5-yl] ethanoate Openeye Name: 1-[(1E,3E)-4-[2-(5-hydroxypentyl)phenyl]buta-1,3-dienyl]undecyl acetate CAS Name: acetic acid [(1E,3E)-1-[2-(5-hydroxypentyl)phenyl]pentadeca-1,3-dien-5-yl] ester IUPAC Name: [(1E,3E)-1-[2-(5-hydroxypentyl)phenyl]pentadeca-1,3-dien-5-yl] acetate Traditional Name: acetic acid [(2E,4E)-1-decyl-5-[2-(5-hydroxypentyl)phenyl]penta-2,4-dienyl] ester Formula: C28H44O3 MolecularWeight: 428.64716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C=CC=CC1=CC=CC=C1CCCCCO)OC(=O)C

Isomeric SMILES

CCCCCCCCCCC(/C=C/C=C/C1=CC=CC=C1CCCCCO)OC(=O)C

InChI

InChI=1S/C28H44O3/c1-3-4-5-6-7-8-9-12-22-28(31-25(2)30)23-16-15-21-27-20-14-13-19-26(27)18-11-10-17-24-29/h13-16,19-21,23,28-29H,3-12,17-18,22,24H2,1-2H3/b21-15+,23-16+