ethyl 7-[2-(2-methyl-2-oxidanyl-3-phenyl-propyl)sulfanyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: ethyl 7-[2-(2-methyl-2-oxidanyl-3-phenyl-propyl)sulfanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: ethyl 7-[2-(2-hydroxy-2-methyl-3-phenyl-propyl)sulfanyl-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[2-[(2-hydroxy-2-methyl-3-phenylpropyl)thio]-5-oxocyclopentyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-(2-hydroxy-2-methyl-3-phenylpropyl)sulfanyl-5-oxocyclopentyl]heptanoate Traditional Name: 7-[2-[(2-hydroxy-2-methyl-3-phenyl-propyl)thio]-5-keto-cyclopentyl]enanthic acid ethyl ester Formula: C24H36O4S MolecularWeight: 420.60524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC1C(CCC1=O)SCC(C)(CC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)CCCCCCC1C(CCC1=O)SCC(C)(CC2=CC=CC=C2)O

InChI

InChI=1S/C24H36O4S/c1-3-28-23(26)14-10-5-4-9-13-20-21(25)15-16-22(20)29-18-24(2,27)17-19-11-7-6-8-12-19/h6-8,11-12,20,22,27H,3-5,9-10,13-18H2,1-2H3