2-methoxy-N1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]benzene-1,4-diamine chloride

Systemtic Name: 2-methoxy-N1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]benzene-1,4-diamine chloride Openeye Name: 2-methoxy-N1-[2-(3-methylimidazol-3-ium-1-yl)ethyl]benzene-1,4-diamine chloride CAS Name: 2-methoxy-N1-[2-(3-methyl-1-imidazol-3-iumyl)ethyl]benzene-1,4-diamine chloride IUPAC Name: 2-methoxy-1-N-[2-(3-methylimidazol-3-ium-1-yl)ethyl]benzene-1,4-diamine chloride Traditional Name: (4-amino-2-methoxy-phenyl)-[2-(3-methylimidazol-3-ium-1-yl)ethyl]amine chloride Formula: C13H19ClN4O MolecularWeight: 282.76916

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CCNC2=C(C=C(C=C2)N)OC.[Cl-]

Isomeric SMILES

C[N+]1=CN(C=C1)CCNC2=C(C=C(C=C2)N)OC.[Cl-]

InChI

InChI=1S/C13H19N4O.ClH/c1-16-7-8-17(10-16)6-5-15-12-4-3-11(14)9-13(12)18-2;/h3-4,7-10,15H,5-6,14H2,1-2H3;1H/q+1;/p-1