ethyl 3-azanyl-1-(4-bromophenyl)carbonyl-5-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-azanyl-1-(4-bromophenyl)carbonyl-5-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 3-amino-1-(4-bromobenzoyl)-5-phenyl-pyrazole-4-carboxylate CAS Name: 3-amino-1-[(4-bromophenyl)-oxomethyl]-5-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-1-(4-bromobenzoyl)-5-phenylpyrazole-4-carboxylate Traditional Name: 3-amino-1-(4-bromobenzoyl)-5-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C19H16BrN3O3 MolecularWeight: 414.25264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1N)C(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1N)C(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C19H16BrN3O3/c1-2-26-19(25)15-16(12-6-4-3-5-7-12)23(22-17(15)21)18(24)13-8-10-14(20)11-9-13/h3-11H,2H2,1H3,(H2,21,22)