methyl (1S,6R)-6-methyl-4-[(2-methylphenyl)amino]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1S,6R)-6-methyl-4-[(2-methylphenyl)amino]-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1S,6R)-6-methyl-4-(2-methylanilino)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-methyl-4-(2-methylanilino)-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,6R)-6-methyl-4-(2-methylanilino)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-2-keto-6-methyl-4-(o-toluidino)cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(=O)C1C(=O)OC)NC2=CC=CC=C2C

Isomeric SMILES

C[C@@H]1CC(=CC(=O)[C@H]1C(=O)OC)NC2=CC=CC=C2C

InChI

InChI=1S/C16H19NO3/c1-10-6-4-5-7-13(10)17-12-8-11(2)15(14(18)9-12)16(19)20-3/h4-7,9,11,15,17H,8H2,1-3H3/t11-,15+/m1/s1