methyl 4-methyl-3-[[(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]amino]benzoate

Systemtic Name: methyl 4-methyl-3-[[(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]amino]benzoate Openeye Name: methyl 4-methyl-3-[[(1S)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl]amino]benzoate CAS Name: 4-methyl-3-[[(2S)-1-(3-methylanilino)-1-oxopropan-2-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[(2S)-1-(3-methylanilino)-1-oxopropan-2-yl]amino]benzoate Traditional Name: 3-[[(1S)-2-keto-1-methyl-2-(m-toluidino)ethyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)NC2=C(C=CC(=C2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@H](C)NC2=C(C=CC(=C2)C(=O)OC)C

InChI

InChI=1S/C19H22N2O3/c1-12-6-5-7-16(10-12)21-18(22)14(3)20-17-11-15(19(23)24-4)9-8-13(17)2/h5-11,14,20H,1-4H3,(H,21,22)/t14-/m0/s1