5-methyl-4-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)methyl]-2-phenyl-4H-pyrazol-3-one hydrochloride

Systemtic Name: 5-methyl-4-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)methyl]-2-phenyl-4H-pyrazol-3-one hydrochloride Openeye Name: 5-methyl-4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methyl]-2-phenyl-4H-pyrazol-3-one hydrochloride CAS Name: 5-methyl-4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methyl]-2-phenyl-4H-pyrazol-3-one hydrochloride IUPAC Name: 5-methyl-4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methyl]-2-phenyl-4H-pyrazol-3-one hydrochloride Traditional Name: 4-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)methyl]-5-methyl-2-phenyl-2-pyrazolin-3-one hydrochloride Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1CC2C(=NN(C2=O)C3=CC=CC=C3)C)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=NN(C(=O)C1CC2C(=NN(C2=O)C3=CC=CC=C3)C)C4=CC=CC=C4.Cl

InChI

InChI=1S/C21H20N4O2.ClH/c1-14-18(20(26)24(22-14)16-9-5-3-6-10-16)13-19-15(2)23-25(21(19)27)17-11-7-4-8-12-17;/h3-12,18-19H,13H2,1-2H3;1H