2-[5-imidazol-1-yl-1-(methylaminomethyl)benzimidazol-1-ium-1-yl]-3-methoxy-phenol

Systemtic Name: 2-[5-imidazol-1-yl-1-(methylaminomethyl)benzimidazol-1-ium-1-yl]-3-methoxy-phenol Openeye Name: 2-[5-imidazol-1-yl-1-(methylaminomethyl)benzimidazol-1-ium-1-yl]-3-methoxy-phenol CAS Name: 2-[5-(1-imidazolyl)-1-(methylaminomethyl)-1-benzimidazol-1-iumyl]-3-methoxyphenol IUPAC Name: 2-[5-imidazol-1-yl-1-(methylaminomethyl)benzimidazol-1-ium-1-yl]-3-methoxyphenol Traditional Name: 2-[5-imidazol-1-yl-1-(methylaminomethyl)benzimidazol-1-ium-1-yl]-3-methoxy-phenol Formula: C19H20N5O2+ MolecularWeight: 350.3944

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Descriptors Computed from Structure

Canonical SMILES:

CNC[N+]1(C=NC2=C1C=CC(=C2)N3C=CN=C3)C4=C(C=CC=C4OC)O

Isomeric SMILES

CNC[N+]1(C=NC2=C1C=CC(=C2)N3C=CN=C3)C4=C(C=CC=C4OC)O

InChI

InChI=1S/C19H19N5O2/c1-20-12-24(19-17(25)4-3-5-18(19)26-2)13-22-15-10-14(6-7-16(15)24)23-9-8-21-11-23/h3-11,13,20H,12H2,1-2H3/p+1