N1-methyl-4-[[2-(3-methylimidazol-3-ium-1-yl)ethylamino]methyl]benzene-1,2-diamine

Systemtic Name: N1-methyl-4-[[2-(3-methylimidazol-3-ium-1-yl)ethylamino]methyl]benzene-1,2-diamine Openeye Name: N1-methyl-4-[[2-(3-methylimidazol-3-ium-1-yl)ethylamino]methyl]benzene-1,2-diamine CAS Name: N1-methyl-4-[[2-(3-methyl-1-imidazol-3-iumyl)ethylamino]methyl]benzene-1,2-diamine IUPAC Name: 1-N-methyl-4-[[2-(3-methylimidazol-3-ium-1-yl)ethylamino]methyl]benzene-1,2-diamine Traditional Name: [3-amino-4-(methylamino)benzyl]-[2-(3-methylimidazol-3-ium-1-yl)ethyl]amine Formula: C14H22N5+ MolecularWeight: 260.35798

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)CNCCN2C=C[N+](=C2)C)N

Isomeric SMILES

CNC1=C(C=C(C=C1)CNCCN2C=C[N+](=C2)C)N

InChI

InChI=1S/C14H22N5/c1-16-14-4-3-12(9-13(14)15)10-17-5-6-19-8-7-18(2)11-19/h3-4,7-9,11,16-17H,5-6,10,15H2,1-2H3/q+1