[(5E,12E)-2-oxidanyl-4-oxidanylidene-henicosa-5,12-dienyl] ethanoate

Systemtic Name: [(5E,12E)-2-oxidanyl-4-oxidanylidene-henicosa-5,12-dienyl] ethanoate Openeye Name: [(5E,12E)-2-hydroxy-4-oxo-henicosa-5,12-dienyl] acetate CAS Name: acetic acid [(5E,12E)-2-hydroxy-4-oxoheneicosa-5,12-dienyl] ester IUPAC Name: [(5E,12E)-2-hydroxy-4-oxohenicosa-5,12-dienyl] acetate Traditional Name: acetic acid [(5E,12E)-2-hydroxy-4-keto-heneicosa-5,12-dienyl] ester Formula: C23H40O4 MolecularWeight: 380.5613

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCC=CC(=O)CC(COC(=O)C)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCC/C=C/C(=O)CC(COC(=O)C)O

InChI

InChI=1S/C23H40O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)19-23(26)20-27-21(2)24/h10-11,17-18,23,26H,3-9,12-16,19-20H2,1-2H3/b11-10+,18-17+