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6-[2-azanyl-3-(phenylmethyl)benzimidazol-3-ium-1-yl]hexan-1-ol

6-[2-azanyl-3-(phenylmethyl)benzimidazol-3-ium-1-yl]hexan-1-ol

Systemtic Name:6-[2-azanyl-3-(phenylmethyl)benzimidazol-3-ium-1-yl]hexan-1-ol
Openeye Name:6-(2-amino-3-benzyl-benzimidazol-3-ium-1-yl)hexan-1-ol
CAS Name:6-[2-amino-3-(phenylmethyl)-1-benzimidazol-3-iumyl]-1-hexanol
IUPAC Name:6-(2-amino-3-benzylbenzimidazol-3-ium-1-yl)hexan-1-ol
Traditional Name:6-(2-amino-3-benzyl-benzimidazol-3-ium-1-yl)hexan-1-ol
Formula: C20H26N3O+
MolecularWeight: 324.43994
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(N(C3=CC=CC=C32)CCCCCCO)N


Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(N(C3=CC=CC=C32)CCCCCCO)N


InChI

InChI=1S/C20H25N3O/c21-20-22(14-8-1-2-9-15-24)18-12-6-7-13-19(18)23(20)16-17-10-4-3-5-11-17/h3-7,10-13,21,24H,1-2,8-9,14-16H2/p+1


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