dimethyl (1S,2R,3R,4S)-4-methyl-2-(4-methylphenyl)-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate

Systemtic Name: dimethyl (1S,2R,3R,4S)-4-methyl-2-(4-methylphenyl)-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: dimethyl (1S,2R,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-(p-tolyl)cyclohexane-1,3-dicarboxylate CAS Name: (1S,2R,3R,4S)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxocyclohexane-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,2R,3R,4S)-4-hydroxy-4-methyl-2-(4-methylphenyl)-6-oxocyclohexane-1,3-dicarboxylate Traditional Name: (1S,2R,3R,4S)-4-hydroxy-6-keto-4-methyl-2-(p-tolyl)cyclohexane-1,3-dicarboxylic acid dimethyl ester Formula: C18H22O6 MolecularWeight: 334.36368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)OC)(C)O)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2[C@@H](C(=O)C[C@]([C@@H]2C(=O)OC)(C)O)C(=O)OC

InChI

InChI=1S/C18H22O6/c1-10-5-7-11(8-6-10)13-14(16(20)23-3)12(19)9-18(2,22)15(13)17(21)24-4/h5-8,13-15,22H,9H2,1-4H3/t13-,14+,15-,18-/m0/s1