[6-[[2-(hydroxymethyl)-3H-benzimidazol-5-yl]methyl]-1H-benzimidazol-3-ium-2-yl]methanol

Systemtic Name: [6-[[2-(hydroxymethyl)-3H-benzimidazol-5-yl]methyl]-1H-benzimidazol-3-ium-2-yl]methanol Openeye Name: [6-[[2-(hydroxymethyl)-3H-benzimidazol-5-yl]methyl]-1H-benzimidazol-3-ium-2-yl]methanol CAS Name: [6-[[2-(hydroxymethyl)-3H-benzimidazol-5-yl]methyl]-1H-benzimidazol-3-ium-2-yl]methanol IUPAC Name: [6-[[2-(hydroxymethyl)-3H-benzimidazol-5-yl]methyl]-1H-benzimidazol-3-ium-2-yl]methanol Traditional Name: [6-[(2-methylol-3H-benzimidazol-5-yl)methyl]-1H-benzimidazol-3-ium-2-yl]methanol Formula: C17H17N4O2+ MolecularWeight: 309.34248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CC3=CC4=C(C=C3)N=C(N4)CO)NC(=[NH+]2)CO

Isomeric SMILES

C1=CC2=C(C=C1CC3=CC4=C(C=C3)N=C(N4)CO)NC(=[NH+]2)CO

InChI

InChI=1S/C17H16N4O2/c22-8-16-18-12-3-1-10(6-14(12)20-16)5-11-2-4-13-15(7-11)21-17(9-23)19-13/h1-4,6-7,22-23H,5,8-9H2,(H,18,20)(H,19,21)/p+1