3-[(5-methylpyridin-1-ium-2-yl)-(pyridin-3-ylmethyl)amino]-N'-oxidanyl-propanimidamide

Systemtic Name: 3-[(5-methylpyridin-1-ium-2-yl)-(pyridin-3-ylmethyl)amino]-N'-oxidanyl-propanimidamide Openeye Name: N'-hydroxy-3-[(5-methylpyridin-1-ium-2-yl)-(3-pyridylmethyl)amino]propanamidine CAS Name: N'-hydroxy-3-[(5-methyl-2-pyridin-1-iumyl)-(3-pyridinylmethyl)amino]propanimidamide IUPAC Name: N'-hydroxy-3-[(5-methylpyridin-1-ium-2-yl)-(pyridin-3-ylmethyl)amino]propanimidamide Traditional Name: N'-hydroxy-3-[(5-methylpyridin-1-ium-2-yl)-(3-pyridylmethyl)amino]propionamidine Formula: C15H20N5O+ MolecularWeight: 286.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C=C1)N(CCC(=NO)N)CC2=CN=CC=C2

Isomeric SMILES

CC1=C[NH+]=C(C=C1)N(CC/C(=N\O)/N)CC2=CN=CC=C2

InChI

InChI=1S/C15H19N5O/c1-12-4-5-15(18-9-12)20(8-6-14(16)19-21)11-13-3-2-7-17-10-13/h2-5,7,9-10,21H,6,8,11H2,1H3,(H2,16,19)/p+1