2-(2,3,4-trimethoxyphenyl)-1H-benzimidazol-3-ium

Systemtic Name: 2-(2,3,4-trimethoxyphenyl)-1H-benzimidazol-3-ium Openeye Name: 2-(2,3,4-trimethoxyphenyl)-1H-benzimidazol-3-ium CAS Name: 2-(2,3,4-trimethoxyphenyl)-1H-benzimidazol-3-ium IUPAC Name: 2-(2,3,4-trimethoxyphenyl)-1H-benzimidazol-3-ium Traditional Name: 2-(2,3,4-trimethoxyphenyl)-1H-benzimidazol-3-ium Formula: C16H17N2O3+ MolecularWeight: 285.31778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=[NH+]C3=CC=CC=C3N2)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=[NH+]C3=CC=CC=C3N2)OC)OC

InChI

InChI=1S/C16H16N2O3/c1-19-13-9-8-10(14(20-2)15(13)21-3)16-17-11-6-4-5-7-12(11)18-16/h4-9H,1-3H3,(H,17,18)/p+1