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

Systemtic Name: 7-[2-[(E)-3-(4-hexylphenyl)-3-oxidanylidene-prop-1-enyl]-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-[(E)-3-(4-hexylphenyl)-3-oxo-prop-1-enyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(E)-3-(4-hexylphenyl)-3-oxoprop-1-enyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-[(E)-3-(4-hexylphenyl)-3-oxoprop-1-enyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(E)-3-(4-hexylphenyl)-3-keto-prop-1-enyl]-5-keto-cyclopentyl]enanthic acid Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)C=CC2CCC(=O)C2CCCCCCC(=O)O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)/C=C/C2CCC(=O)C2CCCCCCC(=O)O

InChI

InChI=1S/C27H38O4/c1-2-3-4-7-10-21-13-15-23(16-14-21)25(28)19-17-22-18-20-26(29)24(22)11-8-5-6-9-12-27(30)31/h13-17,19,22,24H,2-12,18,20H2,1H3,(H,30,31)/b19-17+