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

Systemtic Name: (E)-7-[2-(4-methyl-3-oxidanyl-nonyl)-5-oxidanylidene-cyclopent-2-en-1-yl]hept-5-enoic acid Openeye Name: (E)-7-[2-(3-hydroxy-4-methyl-nonyl)-5-oxo-cyclopent-2-en-1-yl]hept-5-enoic acid CAS Name: (E)-7-[2-(3-hydroxy-4-methylnonyl)-5-oxo-1-cyclopent-2-enyl]-5-heptenoic acid IUPAC Name: (E)-7-[2-(3-hydroxy-4-methylnonyl)-5-oxocyclopent-2-en-1-yl]hept-5-enoic acid Traditional Name: (E)-7-[2-(3-hydroxy-4-methyl-nonyl)-5-keto-cyclopent-2-en-1-yl]hept-5-enoic acid Formula: C22H36O4 MolecularWeight: 364.51884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C(CCC1=CCC(=O)C1CC=CCCCC(=O)O)O

Isomeric SMILES

CCCCCC(C)C(CCC1=CCC(=O)C1C/C=C/CCCC(=O)O)O

InChI

InChI=1S/C22H36O4/c1-3-4-7-10-17(2)20(23)15-13-18-14-16-21(24)19(18)11-8-5-6-9-12-22(25)26/h5,8,14,17,19-20,23H,3-4,6-7,9-13,15-16H2,1-2H3,(H,25,26)/b8-5+