5-(4-bromophenyl)-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: 5-(4-bromophenyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: 5-(4-bromophenyl)-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-(4-bromophenyl)-1-phenyl-3-pyrazolecarboxylate IUPAC Name: 5-(4-bromophenyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 5-(4-bromophenyl)-1-phenyl-pyrazole-3-carboxylate Formula: C16H10BrN2O2- MolecularWeight: 342.1668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H11BrN2O2/c17-12-8-6-11(7-9-12)15-10-14(16(20)21)18-19(15)13-4-2-1-3-5-13/h1-10H,(H,20,21)/p-1