3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-amine

Systemtic Name: 3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-amine Openeye Name: 3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-amine CAS Name: 3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-amine IUPAC Name: 3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-amine Traditional Name: [3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-yl]amine Formula: C16H18N3O+ MolecularWeight: 268.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC[N+]2=C(NC3=CC=CC=C32)N

Isomeric SMILES

CC1=CC=CC=C1OCC[N+]2=C(NC3=CC=CC=C32)N

InChI

InChI=1S/C16H17N3O/c1-12-6-2-5-9-15(12)20-11-10-19-14-8-4-3-7-13(14)18-16(19)17/h2-9H,10-11H2,1H3,(H2,17,18)/p+1