methyl 1-ethanoyl-5,5-bis(4-methylphenyl)-4H-pyrazole-3-carboxylate

Systemtic Name: methyl 1-ethanoyl-5,5-bis(4-methylphenyl)-4H-pyrazole-3-carboxylate Openeye Name: methyl 1-acetyl-5,5-bis(p-tolyl)-4H-pyrazole-3-carboxylate CAS Name: 1-acetyl-5,5-bis(4-methylphenyl)-4H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-acetyl-5,5-bis(4-methylphenyl)-4H-pyrazole-3-carboxylate Traditional Name: 1-acetyl-5,5-bis(p-tolyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CC(=NN2C(=O)C)C(=O)OC)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2(CC(=NN2C(=O)C)C(=O)OC)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N2O3/c1-14-5-9-17(10-6-14)21(18-11-7-15(2)8-12-18)13-19(20(25)26-4)22-23(21)16(3)24/h5-12H,13H2,1-4H3