[(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl] 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [(1S)-2-keto-1-methyl-2-(2-phenylanilino)ethyl] ester Formula: C26H23N3O3 MolecularWeight: 425.47912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)OC(C)C(=O)NC3=CC=CC=C3C4=CC=CC=C4)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)O[C@@H](C)C(=O)NC3=CC=CC=C3C4=CC=CC=C4)N=C1C

InChI

InChI=1S/C26H23N3O3/c1-16-17(2)28-24-15-20(13-14-23(24)27-16)26(31)32-18(3)25(30)29-22-12-8-7-11-21(22)19-9-5-4-6-10-19/h4-15,18H,1-3H3,(H,29,30)/t18-/m0/s1