(phenylmethyl) 3-(4-bromophenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: (phenylmethyl) 3-(4-bromophenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: benzyl 3-(4-bromophenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(4-bromophenyl)-1-phenyl-4-pyrazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(4-bromophenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(4-bromophenyl)-1-phenyl-pyrazole-4-carboxylic acid benzyl ester Formula: C23H17BrN2O2 MolecularWeight: 433.29728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CN(N=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CN(N=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C23H17BrN2O2/c24-19-13-11-18(12-14-19)22-21(15-26(25-22)20-9-5-2-6-10-20)23(27)28-16-17-7-3-1-4-8-17/h1-15H,16H2