ethyl (E)-7-[(1R,2S)-2-octyl-5-oxidanylidene-cyclopentyl]hept-2-enoate

Systemtic Name: ethyl (E)-7-[(1R,2S)-2-octyl-5-oxidanylidene-cyclopentyl]hept-2-enoate Openeye Name: ethyl (E)-7-[(1R,2S)-2-octyl-5-oxo-cyclopentyl]hept-2-enoate CAS Name: (E)-7-[(1R,2S)-2-octyl-5-oxocyclopentyl]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[(1R,2S)-2-octyl-5-oxocyclopentyl]hept-2-enoate Traditional Name: (E)-7-[(1R,5S)-2-keto-5-octyl-cyclopentyl]hept-2-enoic acid ethyl ester Formula: C22H38O3 MolecularWeight: 350.53532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(=O)C1CCCCC=CC(=O)OCC

Isomeric SMILES

CCCCCCCC[C@H]1CCC(=O)[C@@H]1CCCC/C=C/C(=O)OCC

InChI

InChI=1S/C22H38O3/c1-3-5-6-7-8-11-14-19-17-18-21(23)20(19)15-12-9-10-13-16-22(24)25-4-2/h13,16,19-20H,3-12,14-15,17-18H2,1-2H3/b16-13+/t19-,20+/m0/s1