3-[(2S)-1-methoxypropan-2-yl]-1H-benzimidazol-3-ium-2-amine

Systemtic Name: 3-[(2S)-1-methoxypropan-2-yl]-1H-benzimidazol-3-ium-2-amine Openeye Name: 3-[(1S)-2-methoxy-1-methyl-ethyl]-1H-benzimidazol-3-ium-2-amine CAS Name: 3-[(2S)-1-methoxypropan-2-yl]-1H-benzimidazol-3-ium-2-amine IUPAC Name: 3-[(2S)-1-methoxypropan-2-yl]-1H-benzimidazol-3-ium-2-amine Traditional Name: [3-[(1S)-2-methoxy-1-methyl-ethyl]-1H-benzimidazol-3-ium-2-yl]amine Formula: C11H16N3O+ MolecularWeight: 206.26424

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)[N+]1=C(NC2=CC=CC=C21)N

Isomeric SMILES

C[C@@H](COC)[N+]1=C(NC2=CC=CC=C21)N

InChI

InChI=1S/C11H15N3O/c1-8(7-15-2)14-10-6-4-3-5-9(10)13-11(14)12/h3-6,8H,7H2,1-2H3,(H2,12,13)/p+1/t8-/m0/s1