(1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C19H16BrN3O3 MolecularWeight: 414.25264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrN3O3/c1-12(18(24)21-15-5-3-2-4-6-15)26-19(25)17-11-16(22-23-17)13-7-9-14(20)10-8-13/h2-12H,1H3,(H,21,24)(H,22,23)