3-[(4-methylpiperazin-4-ium-1-yl)methyl]-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 3-[(4-methylpiperazin-4-ium-1-yl)methyl]-N'-oxidanyl-benzenecarboximidamide Openeye Name: N'-hydroxy-3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzamidine CAS Name: N'-hydroxy-3-[(4-methyl-1-piperazin-4-iumyl)methyl]benzenecarboximidamide IUPAC Name: N'-hydroxy-3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzenecarboximidamide Traditional Name: N'-hydroxy-3-[(4-methylpiperazin-4-ium-1-yl)methyl]benzamidine Formula: C13H21N4O+ MolecularWeight: 249.33204

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC2=CC=CC(=C2)C(=NO)N

Isomeric SMILES

C[NH+]1CCN(CC1)CC2=CC=CC(=C2)/C(=N\O)/N

InChI

InChI=1S/C13H20N4O/c1-16-5-7-17(8-6-16)10-11-3-2-4-12(9-11)13(14)15-18/h2-4,9,18H,5-8,10H2,1H3,(H2,14,15)/p+1