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

Systemtic Name: methyl 3-(3-bromophenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: methyl 3-(3-bromophenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(3-bromophenyl)-1-phenyl-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-bromophenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(3-bromophenyl)-1-phenyl-pyrazole-4-carboxylic acid methyl ester Formula: C17H13BrN2O2 MolecularWeight: 357.20132

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=C1C2=CC(=CC=C2)Br)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN(N=C1C2=CC(=CC=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H13BrN2O2/c1-22-17(21)15-11-20(14-8-3-2-4-9-14)19-16(15)12-6-5-7-13(18)10-12/h2-11H,1H3