decyl 7-[2-(3,3-dimethyl-2-oxidanyl-5-phenyl-pentyl)sulfanyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: decyl 7-[2-(3,3-dimethyl-2-oxidanyl-5-phenyl-pentyl)sulfanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: decyl 7-[2-(2-hydroxy-3,3-dimethyl-5-phenyl-pentyl)sulfanyl-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[2-[(2-hydroxy-3,3-dimethyl-5-phenylpentyl)thio]-5-oxocyclopentyl]heptanoic acid decyl ester IUPAC Name: decyl 7-[2-(2-hydroxy-3,3-dimethyl-5-phenylpentyl)sulfanyl-5-oxocyclopentyl]heptanoate Traditional Name: 7-[2-[(2-hydroxy-3,3-dimethyl-5-phenyl-pentyl)thio]-5-keto-cyclopentyl]enanthic acid decyl ester Formula: C35H58O4S MolecularWeight: 574.89762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CCCCCCC1C(CCC1=O)SCC(C(C)(C)CCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCOC(=O)CCCCCCC1C(CCC1=O)SCC(C(C)(C)CCC2=CC=CC=C2)O

InChI

InChI=1S/C35H58O4S/c1-4-5-6-7-8-9-12-18-27-39-34(38)22-17-11-10-16-21-30-31(36)23-24-32(30)40-28-33(37)35(2,3)26-25-29-19-14-13-15-20-29/h13-15,19-20,30,32-33,37H,4-12,16-18,21-28H2,1-3H3