[(2R)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-chloranyl-2-methoxy-benzoate

Systemtic Name: [(2R)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-chloranyl-2-methoxy-benzoate Openeye Name: [(1R)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 5-chloro-2-methoxy-benzoate CAS Name: 5-chloro-2-methoxybenzoic acid [(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] 5-chloro-2-methoxybenzoate Traditional Name: 5-chloro-2-methoxy-benzoic acid [(1R)-2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C18H18ClNO4 MolecularWeight: 347.79282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@@H](C)OC(=O)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C18H18ClNO4/c1-11-4-7-14(8-5-11)20-17(21)12(2)24-18(22)15-10-13(19)6-9-16(15)23-3/h4-10,12H,1-3H3,(H,20,21)/t12-/m1/s1