methyl (1S,6R)-4-[(2-chloranyl-5-methoxy-phenyl)amino]-6-methyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1S,6R)-4-[(2-chloranyl-5-methoxy-phenyl)amino]-6-methyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1S,6R)-4-(2-chloro-5-methoxy-anilino)-6-methyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-4-(2-chloro-5-methoxyanilino)-6-methyl-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,6R)-4-(2-chloro-5-methoxyanilino)-6-methyl-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-4-(2-chloro-5-methoxy-anilino)-2-keto-6-methyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(=O)C1C(=O)OC)NC2=C(C=CC(=C2)OC)Cl

Isomeric SMILES

C[C@@H]1CC(=CC(=O)[C@H]1C(=O)OC)NC2=C(C=CC(=C2)OC)Cl

InChI

InChI=1S/C16H18ClNO4/c1-9-6-10(7-14(19)15(9)16(20)22-3)18-13-8-11(21-2)4-5-12(13)17/h4-5,7-9,15,18H,6H2,1-3H3/t9-,15+/m1/s1