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

Systemtic Name: 5-methyl-4-[[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-4H-pyrazol-4-yl]-(4-nitrophenyl)methyl]-2-(4-methylphenyl)-4H-pyrazol-3-one Openeye Name: 5-methyl-4-[[3-methyl-5-oxo-1-(p-tolyl)-4H-pyrazol-4-yl]-(4-nitrophenyl)methyl]-2-(p-tolyl)-4H-pyrazol-3-one CAS Name: 5-methyl-4-[[3-methyl-1-(4-methylphenyl)-5-oxo-4H-pyrazol-4-yl]-(4-nitrophenyl)methyl]-2-(4-methylphenyl)-4H-pyrazol-3-one IUPAC Name: 5-methyl-4-[[3-methyl-1-(4-methylphenyl)-5-oxo-4H-pyrazol-4-yl]-(4-nitrophenyl)methyl]-2-(4-methylphenyl)-4H-pyrazol-3-one Traditional Name: 4-[[5-keto-3-methyl-1-(p-tolyl)-2-pyrazolin-4-yl]-(4-nitrophenyl)methyl]-5-methyl-2-(p-tolyl)-2-pyrazolin-3-one Formula: C29H27N5O4 MolecularWeight: 509.55578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(C(=N2)C)C(C3C(=NN(C3=O)C4=CC=C(C=C4)C)C)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(C(=N2)C)C(C3C(=NN(C3=O)C4=CC=C(C=C4)C)C)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H27N5O4/c1-17-5-11-22(12-6-17)32-28(35)25(19(3)30-32)27(21-9-15-24(16-10-21)34(37)38)26-20(4)31-33(29(26)36)23-13-7-18(2)8-14-23/h5-16,25-27H,1-4H3