6-(4-methyl-1,4-diazepan-4-ium-1-yl)-N'-oxidanyl-pyridine-3-carboximidamide

Systemtic Name: 6-(4-methyl-1,4-diazepan-4-ium-1-yl)-N'-oxidanyl-pyridine-3-carboximidamide Openeye Name: N'-hydroxy-6-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridine-3-carboxamidine CAS Name: N'-hydroxy-6-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridinecarboximidamide IUPAC Name: N'-hydroxy-6-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridine-3-carboximidamide Traditional Name: N'-hydroxy-6-(4-methyl-1,4-diazepan-4-ium-1-yl)nicotinamidine Formula: C12H20N5O+ MolecularWeight: 250.3201

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2=NC=C(C=C2)C(=NO)N

Isomeric SMILES

C[NH+]1CCCN(CC1)C2=NC=C(C=C2)/C(=N\O)/N

InChI

InChI=1S/C12H19N5O/c1-16-5-2-6-17(8-7-16)11-4-3-10(9-14-11)12(13)15-18/h3-4,9,18H,2,5-8H2,1H3,(H2,13,15)/p+1