1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)pyridazine-3-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)pyridazine-3-carboxamide Openeye Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)pyridazine-3-carboxamide CAS Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]-3-pyridazinecarboxamide IUPAC Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)pyridazine-3-carboxamide Traditional Name: 1-(2-fluorophenyl)-4-keto-6-methyl-N-(6-pyrrolidinopyridin-1-ium-3-yl)pyridazine-3-carboxamide Formula: C21H21FN5O2+ MolecularWeight: 394.422143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NC3=C[NH+]=C(C=C3)N4CCCC4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NC3=C[NH+]=C(C=C3)N4CCCC4

InChI

InChI=1S/C21H20FN5O2/c1-14-12-18(28)20(25-27(14)17-7-3-2-6-16(17)22)21(29)24-15-8-9-19(23-13-15)26-10-4-5-11-26/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,24,29)/p+1