O2-methyl O1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2S)-3,3-bis(methylsulfanyl)cyclobutane-1,2-dicarboxylate

Systemtic Name: O2-methyl O1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (1S,2S)-3,3-bis(methylsulfanyl)cyclobutane-1,2-dicarboxylate Openeye Name: O1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] O2-methyl (1S,2S)-3,3-bis(methylsulfanyl)cyclobutane-1,2-dicarboxylate CAS Name: (1S,2S)-3,3-bis(methylthio)cyclobutane-1,2-dicarboxylic acid O2-methyl ester O1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: 2-O-methyl 1-O-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (1S,2S)-3,3-bis(methylsulfanyl)cyclobutane-1,2-dicarboxylate Traditional Name: (1S,2S)-3,3-bis(methylthio)cyclobutane-1,2-dicarboxylic acid O1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester O2-methyl ester Formula: C19H32O4S2 MolecularWeight: 388.58498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CC(C2C(=O)OC)(SC)SC)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@H]2CC([C@@H]2C(=O)OC)(SC)SC)C(C)C

InChI

InChI=1S/C19H32O4S2/c1-11(2)13-8-7-12(3)9-15(13)23-17(20)14-10-19(24-5,25-6)16(14)18(21)22-4/h11-16H,7-10H2,1-6H3/t12-,13+,14+,15-,16+/m1/s1