[(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-phenylazanylbenzoate

Systemtic Name: [(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-phenylazanylbenzoate Openeye Name: [(1S)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 2-anilinobenzoate CAS Name: 2-anilinobenzoic acid [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylanilino)-1-oxopropan-2-yl] 2-anilinobenzoate Traditional Name: 2-anilinobenzoic acid [(1S)-2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)C2=CC=CC=C2NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)OC(=O)C2=CC=CC=C2NC3=CC=CC=C3

InChI

InChI=1S/C23H22N2O3/c1-16-12-14-19(15-13-16)25-22(26)17(2)28-23(27)20-10-6-7-11-21(20)24-18-8-4-3-5-9-18/h3-15,17,24H,1-2H3,(H,25,26)/t17-/m0/s1