3-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-1-(4-methylphenyl)-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione

Systemtic Name: 3-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-1-(4-methylphenyl)-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione Openeye Name: 3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-1-(p-tolyl)-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione CAS Name: 3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-1-(4-methylphenyl)-4-(1-pyridin-1-iumyl)pyrrole-2,5-dione IUPAC Name: 3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-1-(4-methylphenyl)-4-pyridin-1-ium-1-ylpyrrole-2,5-dione Traditional Name: 3-(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)-1-(p-tolyl)-4-pyridin-1-ium-1-yl-3-pyrroline-2,5-quinone Formula: C26H21N4O3+ MolecularWeight: 437.46994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)[N+]3=CC=CC=C3)C4=C(NN(C4=O)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)[N+]3=CC=CC=C3)C4=C(NN(C4=O)C5=CC=CC=C5)C

InChI

InChI=1S/C26H20N4O3/c1-17-11-13-19(14-12-17)29-24(31)22(23(26(29)33)28-15-7-4-8-16-28)21-18(2)27-30(25(21)32)20-9-5-3-6-10-20/h3-16H,1-2H3/p+1