5-methyl-1-(2-methylphenyl)carbonyl-2-phenyl-4-propan-2-yl-pyrazol-3-one

Systemtic Name: 5-methyl-1-(2-methylphenyl)carbonyl-2-phenyl-4-propan-2-yl-pyrazol-3-one Openeye Name: 4-isopropyl-5-methyl-1-(2-methylbenzoyl)-2-phenyl-pyrazol-3-one CAS Name: 5-methyl-1-[(2-methylphenyl)-oxomethyl]-2-phenyl-4-propan-2-yl-3-pyrazolone IUPAC Name: 5-methyl-1-(2-methylbenzoyl)-2-phenyl-4-propan-2-ylpyrazol-3-one Traditional Name: 4-isopropyl-5-methyl-1-o-toluoyl-2-phenyl-3-pyrazolin-3-one Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2C(=C(C(=O)N2C3=CC=CC=C3)C(C)C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2C(=C(C(=O)N2C3=CC=CC=C3)C(C)C)C

InChI

InChI=1S/C21H22N2O2/c1-14(2)19-16(4)22(20(24)18-13-9-8-10-15(18)3)23(21(19)25)17-11-6-5-7-12-17/h5-14H,1-4H3