6-azanyl-3-methyl-4-(1-methylpyridin-1-ium-3-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile iodide

Systemtic Name: 6-azanyl-3-methyl-4-(1-methylpyridin-1-ium-3-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile iodide Openeye Name: 6-amino-3-methyl-4-(1-methylpyridin-1-ium-3-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile iodide CAS Name: 6-amino-3-methyl-4-(1-methyl-3-pyridin-1-iumyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile iodide IUPAC Name: 6-amino-3-methyl-4-(1-methylpyridin-1-ium-3-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile iodide Traditional Name: 6-amino-3-methyl-4-(1-methylpyridin-1-ium-3-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile iodide Formula: C14H14IN5O MolecularWeight: 395.19833

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=C[N+](=CC=C3)C.[I-]

Isomeric SMILES

CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=C[N+](=CC=C3)C.[I-]

InChI

InChI=1S/C14H14N5O.HI/c1-8-11-12(9-4-3-5-19(2)7-9)10(6-15)13(16)20-14(11)18-17-8;/h3-5,7,12H,16H2,1-2H3,(H,17,18);1H/q+1;/p-1