[(2S)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-phenyl-1H-pyrazole-4-carboxylate

Systemtic Name: [(2S)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-phenyl-1H-pyrazole-4-carboxylate Openeye Name: [(1S)-1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 5-phenyl-1H-pyrazole-4-carboxylate CAS Name: 5-phenyl-1H-pyrazole-4-carboxylic acid [(2S)-1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylanilino)-1-oxopropan-2-yl] 5-phenyl-1H-pyrazole-4-carboxylate Traditional Name: 5-phenyl-1H-pyrazole-4-carboxylic acid [(1S)-2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=C(NN=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C)OC(=O)C2=C(NN=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3/c1-13-8-6-7-11-17(13)22-19(24)14(2)26-20(25)16-12-21-23-18(16)15-9-4-3-5-10-15/h3-12,14H,1-2H3,(H,21,23)(H,22,24)/t14-/m0/s1