(2S)-1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(2-methylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(2-methylphenoxy)propan-2-ol Openeye Name: (2S)-1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(2-methylphenoxy)propan-2-ol CAS Name: (2S)-1-(3-ethyl-1-benzimidazol-1-iumyl)-3-(2-methylphenoxy)-2-propanol IUPAC Name: (2S)-1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(2-methylphenoxy)propan-2-ol Traditional Name: (2S)-1-(3-ethylbenzimidazol-1-ium-1-yl)-3-(2-methylphenoxy)propan-2-ol Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=[N+](C2=CC=CC=C21)CC(COC3=CC=CC=C3C)O

Isomeric SMILES

CCN1C=[N+](C2=CC=CC=C21)C[C@@H](COC3=CC=CC=C3C)O

InChI

InChI=1S/C19H23N2O2/c1-3-20-14-21(18-10-6-5-9-17(18)20)12-16(22)13-23-19-11-7-4-8-15(19)2/h4-11,14,16,22H,3,12-13H2,1-2H3/q+1/t16-/m0/s1