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

Systemtic Name: 3-(3-ethylpyridin-1-ium-1-yl)-4-[2-(4-fluorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-1-(4-methoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-(3-ethylpyridin-1-ium-1-yl)-4-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(4-methoxyphenyl)pyrrole-2,5-dione CAS Name: 3-(3-ethyl-1-pyridin-1-iumyl)-4-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(4-methoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-(3-ethylpyridin-1-ium-1-yl)-4-[2-(4-fluorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(4-methoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-(3-ethylpyridin-1-ium-1-yl)-4-[1-(4-fluorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]-1-(4-methoxyphenyl)-3-pyrroline-2,5-quinone Formula: C28H24FN4O4+ MolecularWeight: 499.512963

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=CC=C1)C2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC)C4=C(NN(C4=O)C5=CC=C(C=C5)F)C

Isomeric SMILES

CCC1=C[N+](=CC=C1)C2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC)C4=C(NN(C4=O)C5=CC=C(C=C5)F)C

InChI

InChI=1S/C28H23FN4O4/c1-4-18-6-5-15-31(16-18)25-24(26(34)32(28(25)36)20-11-13-22(37-3)14-12-20)23-17(2)30-33(27(23)35)21-9-7-19(29)8-10-21/h5-16H,4H2,1-3H3/p+1