3-(3,4-dimethylpyridin-1-ium-1-yl)-4-[3-ethyl-1-(4-fluorophenyl)-5-oxidanylidene-pyrazol-4-ylidene]-5-oxidanylidene-1-phenyl-pyrrol-2-olate

Systemtic Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-4-[3-ethyl-1-(4-fluorophenyl)-5-oxidanylidene-pyrazol-4-ylidene]-5-oxidanylidene-1-phenyl-pyrrol-2-olate Openeye Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-4-[3-ethyl-1-(4-fluorophenyl)-5-oxo-pyrazol-4-ylidene]-5-oxo-1-phenyl-pyrrol-2-olate CAS Name: 3-(3,4-dimethyl-1-pyridin-1-iumyl)-4-[3-ethyl-1-(4-fluorophenyl)-5-oxo-4-pyrazolylidene]-5-oxo-1-phenyl-2-pyrrololate IUPAC Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-4-[3-ethyl-1-(4-fluorophenyl)-5-oxopyrazol-4-ylidene]-5-oxo-1-phenylpyrrol-2-olate Traditional Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-4-[3-ethyl-1-(4-fluorophenyl)-5-keto-2-pyrazolin-4-ylidene]-5-keto-1-phenyl-2-pyrrolin-2-olate Formula: C28H23FN4O3 MolecularWeight: 482.505623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C1=C2C(=C(N(C2=O)C3=CC=CC=C3)[O-])[N+]4=CC(=C(C=C4)C)C)C5=CC=C(C=C5)F

Isomeric SMILES

CCC1=NN(C(=O)C1=C2C(=C(N(C2=O)C3=CC=CC=C3)[O-])[N+]4=CC(=C(C=C4)C)C)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H23FN4O3/c1-4-22-23(27(35)33(30-22)21-12-10-19(29)11-13-21)24-25(31-15-14-17(2)18(3)16-31)28(36)32(26(24)34)20-8-6-5-7-9-20/h5-16H,4H2,1-3H3