(E)-7-[1-butyl-5-oxidanylidene-2-(3-oxidanyl-4-phenoxy-butyl)cyclopent-2-en-1-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[1-butyl-5-oxidanylidene-2-(3-oxidanyl-4-phenoxy-butyl)cyclopent-2-en-1-yl]hept-5-enoic acid Openeye Name: (E)-7-[1-butyl-2-(3-hydroxy-4-phenoxy-butyl)-5-oxo-cyclopent-2-en-1-yl]hept-5-enoic acid CAS Name: (E)-7-[1-butyl-2-(3-hydroxy-4-phenoxybutyl)-5-oxo-1-cyclopent-2-enyl]-5-heptenoic acid IUPAC Name: (E)-7-[1-butyl-2-(3-hydroxy-4-phenoxybutyl)-5-oxocyclopent-2-en-1-yl]hept-5-enoic acid Traditional Name: (E)-7-[1-butyl-2-(3-hydroxy-4-phenoxy-butyl)-5-keto-cyclopent-2-en-1-yl]hept-5-enoic acid Formula: C26H36O5 MolecularWeight: 428.56104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)CC=C1CCC(COC2=CC=CC=C2)O)CC=CCCCC(=O)O

Isomeric SMILES

CCCCC1(C(=O)CC=C1CCC(COC2=CC=CC=C2)O)C/C=C/CCCC(=O)O

InChI

InChI=1S/C26H36O5/c1-2-3-18-26(19-10-5-4-9-13-25(29)30)21(15-17-24(26)28)14-16-22(27)20-31-23-11-7-6-8-12-23/h5-8,10-12,15,22,27H,2-4,9,13-14,16-20H2,1H3,(H,29,30)/b10-5+