(1S)-2-(2-azanyl-3-methyl-benzimidazol-3-ium-1-yl)-1-phenyl-ethanol

Systemtic Name: (1S)-2-(2-azanyl-3-methyl-benzimidazol-3-ium-1-yl)-1-phenyl-ethanol Openeye Name: (1S)-2-(2-amino-3-methyl-benzimidazol-3-ium-1-yl)-1-phenyl-ethanol CAS Name: (1S)-2-(2-amino-3-methyl-1-benzimidazol-3-iumyl)-1-phenylethanol IUPAC Name: (1S)-2-(2-amino-3-methylbenzimidazol-3-ium-1-yl)-1-phenylethanol Traditional Name: (1S)-2-(2-amino-3-methyl-benzimidazol-3-ium-1-yl)-1-phenyl-ethanol Formula: C16H18N3O+ MolecularWeight: 268.33362

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C2=CC=CC=C21)CC(C3=CC=CC=C3)O)N

Isomeric SMILES

C[N+]1=C(N(C2=CC=CC=C21)C[C@H](C3=CC=CC=C3)O)N

InChI

InChI=1S/C16H17N3O/c1-18-13-9-5-6-10-14(13)19(16(18)17)11-15(20)12-7-3-2-4-8-12/h2-10,15,17,20H,11H2,1H3/p+1/t15-/m1/s1