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

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 3-(4-bromophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C18H14BrN3O3 MolecularWeight: 400.22606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H14BrN3O3/c19-13-8-6-12(7-9-13)15-10-16(22-21-15)18(24)25-11-17(23)20-14-4-2-1-3-5-14/h1-10H,11H2,(H,20,23)(H,21,22)