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

Systemtic Name: 3-[2-(4-chlorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-1-(3-methylphenyl)-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione Openeye Name: 3-[2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(m-tolyl)-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione CAS Name: 3-[2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(3-methylphenyl)-4-(1-pyridin-1-iumyl)pyrrole-2,5-dione IUPAC Name: 3-[2-(4-chlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(3-methylphenyl)-4-pyridin-1-ium-1-ylpyrrole-2,5-dione Traditional Name: 3-[1-(4-chlorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]-1-(m-tolyl)-4-pyridin-1-ium-1-yl-3-pyrroline-2,5-quinone Formula: C26H20ClN4O3+ MolecularWeight: 471.915

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H19ClN4O3/c1-16-7-6-8-20(15-16)30-24(32)22(23(26(30)34)29-13-4-3-5-14-29)21-17(2)28-31(25(21)33)19-11-9-18(27)10-12-19/h3-15H,1-2H3/p+1