(1S)-2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol

Systemtic Name: (1S)-2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol Openeye Name: (1S)-2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol CAS Name: (1S)-2-(2-amino-3-ethyl-1-benzimidazol-1-iumyl)-1-(4-chlorophenyl)ethanol IUPAC Name: (1S)-2-(2-amino-3-ethylbenzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol Traditional Name: (1S)-2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-chlorophenyl)ethanol Formula: C17H19ClN3O+ MolecularWeight: 316.80526

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2[N+](=C1N)CC(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCN1C2=CC=CC=C2[N+](=C1N)C[C@H](C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C17H18ClN3O/c1-2-20-14-5-3-4-6-15(14)21(17(20)19)11-16(22)12-7-9-13(18)10-8-12/h3-10,16,19,22H,2,11H2,1H3/p+1/t16-/m1/s1