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

Systemtic Name: 5-(4-methylphenyl)-1-phenyl-pyrazole-3-carboxylate Openeye Name: 1-phenyl-5-(p-tolyl)pyrazole-3-carboxylate CAS Name: 5-(4-methylphenyl)-1-phenyl-3-pyrazolecarboxylate IUPAC Name: 5-(4-methylphenyl)-1-phenylpyrazole-3-carboxylate Traditional Name: 1-phenyl-5-(p-tolyl)pyrazole-3-carboxylate Formula: C17H13N2O2- MolecularWeight: 277.29732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C17H14N2O2/c1-12-7-9-13(10-8-12)16-11-15(17(20)21)18-19(16)14-5-3-2-4-6-14/h2-11H,1H3,(H,20,21)/p-1