(2S)-1-[[3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol

Systemtic Name: (2S)-1-[[3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Openeye Name: (2S)-1-[[3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol CAS Name: (2S)-1-[[3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-yl]amino]-2-propanol IUPAC Name: (2S)-1-[[3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Traditional Name: (2S)-1-[[3-[2-(2-methylphenoxy)ethyl]-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=CC=C1OCC[N+]2=C(NC3=CC=CC=C32)NC[C@H](C)O

InChI

InChI=1S/C19H23N3O2/c1-14-7-3-6-10-18(14)24-12-11-22-17-9-5-4-8-16(17)21-19(22)20-13-15(2)23/h3-10,15,23H,11-13H2,1-2H3,(H,20,21)/p+1/t15-/m0/s1