ethyl 1-(2-methylphenyl)-5-phenyl-4-(phenylcarbonyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(2-methylphenyl)-5-phenyl-4-(phenylcarbonyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-benzoyl-1-(o-tolyl)-5-phenyl-pyrazole-3-carboxylate CAS Name: 4-benzoyl-1-(2-methylphenyl)-5-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzoyl-1-(2-methylphenyl)-5-phenylpyrazole-3-carboxylate Traditional Name: 4-benzoyl-1-(o-tolyl)-5-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C(=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C(=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4C

InChI

InChI=1S/C26H22N2O3/c1-3-31-26(30)23-22(25(29)20-15-8-5-9-16-20)24(19-13-6-4-7-14-19)28(27-23)21-17-11-10-12-18(21)2/h4-17H,3H2,1-2H3