7-[2-[(E)-3-(4-heptylphenyl)-3-oxidanylidene-prop-1-enyl]-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[(E)-3-(4-heptylphenyl)-3-oxidanylidene-prop-1-enyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-[(E)-3-(4-heptylphenyl)-3-oxo-prop-1-enyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(E)-3-(4-heptylphenyl)-3-oxoprop-1-enyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-[(E)-3-(4-heptylphenyl)-3-oxoprop-1-enyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(E)-3-(4-heptylphenyl)-3-keto-prop-1-enyl]-5-keto-cyclopentyl]enanthic acid Formula: C28H40O4 MolecularWeight: 440.6148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)C=CC2CCC(=O)C2CCCCCCC(=O)O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)/C=C/C2CCC(=O)C2CCCCCCC(=O)O

InChI

InChI=1S/C28H40O4/c1-2-3-4-5-8-11-22-14-16-24(17-15-22)26(29)20-18-23-19-21-27(30)25(23)12-9-6-7-10-13-28(31)32/h14-18,20,23,25H,2-13,19,21H2,1H3,(H,31,32)/b20-18+