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

Systemtic Name: phenacyl 3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: phenacyl 1-phenyl-3-(p-tolyl)pyrazole-4-carboxylate CAS Name: 3-(4-methylphenyl)-1-phenyl-4-pyrazolecarboxylic acid phenacyl ester IUPAC Name: phenacyl 3-(4-methylphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(p-tolyl)pyrazole-4-carboxylic acid phenacyl ester Formula: C25H20N2O3 MolecularWeight: 396.4379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H20N2O3/c1-18-12-14-20(15-13-18)24-22(16-27(26-24)21-10-6-3-7-11-21)25(29)30-17-23(28)19-8-4-2-5-9-19/h2-16H,17H2,1H3