methyl 4a-methyl-1-oxidanyl-8-oxidanylidene-4-phenylsulfanyl-7-propan-2-yl-3,4,5,6,7,8a-hexahydro-2H-naphthalene-1-carboxylate

Systemtic Name: methyl 4a-methyl-1-oxidanyl-8-oxidanylidene-4-phenylsulfanyl-7-propan-2-yl-3,4,5,6,7,8a-hexahydro-2H-naphthalene-1-carboxylate Openeye Name: methyl 1-hydroxy-7-isopropyl-4a-methyl-8-oxo-4-phenylsulfanyl-decalin-1-carboxylate CAS Name: 1-hydroxy-4a-methyl-8-oxo-4-(phenylthio)-7-propan-2-yl-3,4,5,6,7,8a-hexahydro-2H-naphthalene-1-carboxylic acid methyl ester IUPAC Name: methyl 1-hydroxy-4a-methyl-8-oxo-4-phenylsulfanyl-7-propan-2-yl-3,4,5,6,7,8a-hexahydro-2H-naphthalene-1-carboxylate Traditional Name: 1-hydroxy-7-isopropyl-8-keto-4a-methyl-4-(phenylthio)decalin-1-carboxylic acid methyl ester Formula: C22H30O4S MolecularWeight: 390.5362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC2(C(CCC(C2C1=O)(C(=O)OC)O)SC3=CC=CC=C3)C

Isomeric SMILES

CC(C)C1CCC2(C(CCC(C2C1=O)(C(=O)OC)O)SC3=CC=CC=C3)C

InChI

InChI=1S/C22H30O4S/c1-14(2)16-10-12-21(3)17(27-15-8-6-5-7-9-15)11-13-22(25,20(24)26-4)19(21)18(16)23/h5-9,14,16-17,19,25H,10-13H2,1-4H3