[1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 1,5-dimethylpyrazole-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 1,5-dimethylpyrazole-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2-phenylanilino)ethyl] 1,5-dimethylpyrazole-4-carboxylate CAS Name: 1,5-dimethyl-4-pyrazolecarboxylic acid [1-oxo-1-(2-phenylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2-phenylanilino)propan-2-yl] 1,5-dimethylpyrazole-4-carboxylate Traditional Name: 1,5-dimethylpyrazole-4-carboxylic acid [2-keto-1-methyl-2-(2-phenylanilino)ethyl] ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)OC(C)C(=O)NC2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C)C(=O)OC(C)C(=O)NC2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3/c1-14-18(13-22-24(14)3)21(26)27-15(2)20(25)23-19-12-8-7-11-17(19)16-9-5-4-6-10-16/h4-13,15H,1-3H3,(H,23,25)