[5-oxidanyl-1-[2-[(1E,3E)-5-oxidanyltrideca-1,3-dienyl]phenyl]pentyl] ethanoate

Systemtic Name: [5-oxidanyl-1-[2-[(1E,3E)-5-oxidanyltrideca-1,3-dienyl]phenyl]pentyl] ethanoate Openeye Name: [5-hydroxy-1-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]pentyl] acetate CAS Name: acetic acid [5-hydroxy-1-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]pentyl] ester IUPAC Name: [5-hydroxy-1-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]pentyl] acetate Traditional Name: acetic acid [5-hydroxy-1-[2-[(1E,3E)-5-hydroxytrideca-1,3-dienyl]phenyl]pentyl] ester Formula: C26H40O4 MolecularWeight: 416.5934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CC=CC1=CC=CC=C1C(CCCCO)OC(=O)C)O

Isomeric SMILES

CCCCCCCCC(/C=C/C=C/C1=CC=CC=C1C(CCCCO)OC(=O)C)O

InChI

InChI=1S/C26H40O4/c1-3-4-5-6-7-8-17-24(29)18-11-9-15-23-16-10-12-19-25(23)26(30-22(2)28)20-13-14-21-27/h9-12,15-16,18-19,24,26-27,29H,3-8,13-14,17,20-21H2,1-2H3/b15-9+,18-11+