5-(3-bromophenyl)-2-(2-methylphenyl)pyrazole-3-carboxylate

Systemtic Name: 5-(3-bromophenyl)-2-(2-methylphenyl)pyrazole-3-carboxylate Openeye Name: 5-(3-bromophenyl)-2-(o-tolyl)pyrazole-3-carboxylate CAS Name: 5-(3-bromophenyl)-2-(2-methylphenyl)-3-pyrazolecarboxylate IUPAC Name: 5-(3-bromophenyl)-2-(2-methylphenyl)pyrazole-3-carboxylate Traditional Name: 5-(3-bromophenyl)-2-(o-tolyl)pyrazole-3-carboxylate Formula: C17H12BrN2O2- MolecularWeight: 356.19338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C3=CC(=CC=C3)Br)C(=O)[O-]

InChI

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