methyl (E)-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-4-enyl]cyclopentyl]hept-5-enoate

Systemtic Name: methyl (E)-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-4-enyl]cyclopentyl]hept-5-enoate Openeye Name: methyl (E)-7-[2-[(E)-3-hydroxyoct-4-enyl]-5-oxo-cyclopentyl]hept-5-enoate CAS Name: (E)-7-[2-[(E)-3-hydroxyoct-4-enyl]-5-oxocyclopentyl]-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[2-[(E)-3-hydroxyoct-4-enyl]-5-oxocyclopentyl]hept-5-enoate Traditional Name: (E)-7-[2-[(E)-3-hydroxyoct-4-enyl]-5-keto-cyclopentyl]hept-5-enoic acid methyl ester Formula: C21H34O4 MolecularWeight: 350.49226

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC(CCC1CCC(=O)C1CC=CCCCC(=O)OC)O

Isomeric SMILES

CCC/C=C/C(CCC1CCC(=O)C1C/C=C/CCCC(=O)OC)O

InChI

InChI=1S/C21H34O4/c1-3-4-7-10-18(22)15-13-17-14-16-20(23)19(17)11-8-5-6-9-12-21(24)25-2/h5,7-8,10,17-19,22H,3-4,6,9,11-16H2,1-2H3/b8-5+,10-7+