1-(2-azanyl-3-methyl-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol chloride

Systemtic Name: 1-(2-azanyl-3-methyl-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol chloride Openeye Name: 1-(2-amino-3-methyl-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol chloride CAS Name: 1-(2-amino-3-methyl-1-benzimidazol-3-iumyl)-3-phenoxy-2-propanol chloride IUPAC Name: 1-(2-amino-3-methylbenzimidazol-3-ium-1-yl)-3-phenoxypropan-2-ol chloride Traditional Name: 1-(2-amino-3-methyl-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol chloride Formula: C17H20ClN3O2 MolecularWeight: 333.8126

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C2=CC=CC=C21)CC(COC3=CC=CC=C3)O)N.[Cl-]

Isomeric SMILES

C[N+]1=C(N(C2=CC=CC=C21)CC(COC3=CC=CC=C3)O)N.[Cl-]

InChI

InChI=1S/C17H19N3O2.ClH/c1-19-15-9-5-6-10-16(15)20(17(19)18)11-13(21)12-22-14-7-3-2-4-8-14;/h2-10,13,18,21H,11-12H2,1H3;1H