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

Systemtic Name: 1-(4-methylphenyl)-3-(3-oxidanylidene-2-phenyl-5-propan-2-yl-1H-pyrazol-4-yl)-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione Openeye Name: 3-(5-isopropyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-1-(p-tolyl)-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione CAS Name: 1-(4-methylphenyl)-3-(3-oxo-2-phenyl-5-propan-2-yl-1H-pyrazol-4-yl)-4-(1-pyridin-1-iumyl)pyrrole-2,5-dione IUPAC Name: 1-(4-methylphenyl)-3-(3-oxo-2-phenyl-5-propan-2-yl-1H-pyrazol-4-yl)-4-pyridin-1-ium-1-ylpyrrole-2,5-dione Traditional Name: 3-(3-isopropyl-5-keto-1-phenyl-3-pyrazolin-4-yl)-1-(p-tolyl)-4-pyridin-1-ium-1-yl-3-pyrroline-2,5-quinone Formula: C28H25N4O3+ MolecularWeight: 465.5231

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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(C)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(C)C

InChI

InChI=1S/C28H24N4O3/c1-18(2)24-22(27(34)32(29-24)21-10-6-4-7-11-21)23-25(30-16-8-5-9-17-30)28(35)31(26(23)33)20-14-12-19(3)13-15-20/h4-18H,1-3H3/p+1