propan-2-yl (E)-9-[3-oxidanyl-5-oxidanylidene-2-(3-oxidanylidenedecyl)cyclopentyl]non-7-enoate

Systemtic Name: propan-2-yl (E)-9-[3-oxidanyl-5-oxidanylidene-2-(3-oxidanylidenedecyl)cyclopentyl]non-7-enoate Openeye Name: isopropyl (E)-9-[3-hydroxy-5-oxo-2-(3-oxodecyl)cyclopentyl]non-7-enoate CAS Name: (E)-9-[3-hydroxy-5-oxo-2-(3-oxodecyl)cyclopentyl]-7-nonenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-9-[3-hydroxy-5-oxo-2-(3-oxodecyl)cyclopentyl]non-7-enoate Traditional Name: (E)-9-[3-hydroxy-5-keto-2-(3-ketodecyl)cyclopentyl]non-7-enoic acid isopropyl ester Formula: C27H46O5 MolecularWeight: 450.65114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)CCC1C(CC(=O)C1CC=CCCCCCC(=O)OC(C)C)O

Isomeric SMILES

CCCCCCCC(=O)CCC1C(CC(=O)C1C/C=C/CCCCCC(=O)OC(C)C)O

InChI

InChI=1S/C27H46O5/c1-4-5-6-9-12-15-22(28)18-19-24-23(25(29)20-26(24)30)16-13-10-7-8-11-14-17-27(31)32-21(2)3/h10,13,21,23-24,26,30H,4-9,11-12,14-20H2,1-3H3/b13-10+