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

Systemtic Name: 1-(3-chlorophenyl)-3-[2-(4-fluorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione Openeye Name: 1-(3-chlorophenyl)-3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione CAS Name: 1-(3-chlorophenyl)-3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-4-(1-pyridin-1-iumyl)pyrrole-2,5-dione IUPAC Name: 1-(3-chlorophenyl)-3-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-4-pyridin-1-ium-1-ylpyrrole-2,5-dione Traditional Name: 1-(3-chlorophenyl)-3-[1-(4-fluorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]-4-pyridin-1-ium-1-yl-3-pyrroline-2,5-quinone Formula: C25H17ClFN4O3+ MolecularWeight: 475.878883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)F)C3=C(C(=O)N(C3=O)C4=CC(=CC=C4)Cl)[N+]5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)F)C3=C(C(=O)N(C3=O)C4=CC(=CC=C4)Cl)[N+]5=CC=CC=C5

InChI

InChI=1S/C25H16ClFN4O3/c1-15-20(24(33)31(28-15)18-10-8-17(27)9-11-18)21-22(29-12-3-2-4-13-29)25(34)30(23(21)32)19-7-5-6-16(26)14-19/h2-14H,1H3/p+1