ethyl (E)-7-[2-oxidanylidene-5-(3-oxidanyloctyl)cyclopentyl]hept-2-enoate

Systemtic Name: ethyl (E)-7-[2-oxidanylidene-5-(3-oxidanyloctyl)cyclopentyl]hept-2-enoate Openeye Name: ethyl (E)-7-[2-(3-hydroxyoctyl)-5-oxo-cyclopentyl]hept-2-enoate CAS Name: (E)-7-[2-(3-hydroxyoctyl)-5-oxocyclopentyl]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[2-(3-hydroxyoctyl)-5-oxocyclopentyl]hept-2-enoate Traditional Name: (E)-7-[2-(3-hydroxyoctyl)-5-keto-cyclopentyl]hept-2-enoic acid ethyl ester Formula: C22H38O4 MolecularWeight: 366.53472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC1CCC(=O)C1CCCCC=CC(=O)OCC)O

Isomeric SMILES

CCCCCC(CCC1CCC(=O)C1CCCC/C=C/C(=O)OCC)O

InChI

InChI=1S/C22H38O4/c1-3-5-8-11-19(23)16-14-18-15-17-21(24)20(18)12-9-6-7-10-13-22(25)26-4-2/h10,13,18-20,23H,3-9,11-12,14-17H2,1-2H3/b13-10+