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

Systemtic Name: (2S)-1-[[3-(2-phenoxyethyl)-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Openeye Name: (2S)-1-[[3-(2-phenoxyethyl)-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol CAS Name: (2S)-1-[[3-(2-phenoxyethyl)-1H-benzimidazol-3-ium-2-yl]amino]-2-propanol IUPAC Name: (2S)-1-[[3-(2-phenoxyethyl)-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Traditional Name: (2S)-1-[[3-(2-phenoxyethyl)-1H-benzimidazol-3-ium-2-yl]amino]propan-2-ol Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=[N+](C2=CC=CC=C2N1)CCOC3=CC=CC=C3)O

Isomeric SMILES

C[C@@H](CNC1=[N+](C2=CC=CC=C2N1)CCOC3=CC=CC=C3)O

InChI

InChI=1S/C18H21N3O2/c1-14(22)13-19-18-20-16-9-5-6-10-17(16)21(18)11-12-23-15-7-3-2-4-8-15/h2-10,14,22H,11-13H2,1H3,(H,19,20)/p+1/t14-/m0/s1