3,4,5-trimethoxy-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide CAS Name: 3,4,5-trimethoxy-N-[1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]benzamide Formula: C24H31N4O4+ MolecularWeight: 439.52734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4

InChI

InChI=1S/C24H30N4O4/c1-30-20-15-17(16-21(31-2)22(20)32-3)23(29)26-24-25-18-9-5-6-10-19(18)28(24)14-13-27-11-7-4-8-12-27/h5-6,9-10,15-16H,4,7-8,11-14H2,1-3H3,(H,25,26,29)/p+1