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

Systemtic Name: 1-(4-methoxyphenyl)carbonyl-5-methyl-2-phenyl-4-propan-2-yl-pyrazol-3-one Openeye Name: 4-isopropyl-1-(4-methoxybenzoyl)-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 1-[(4-methoxyphenyl)-oxomethyl]-5-methyl-2-phenyl-4-propan-2-yl-3-pyrazolone IUPAC Name: 1-(4-methoxybenzoyl)-5-methyl-2-phenyl-4-propan-2-ylpyrazol-3-one Traditional Name: 4-isopropyl-5-methyl-1-p-anisoyl-2-phenyl-3-pyrazolin-3-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(C)C

InChI

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