1-(4-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Openeye Name: 1-(4-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide CAS Name: 1-(4-methoxyphenyl)-2-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-5-benzimidazolecarboxamide IUPAC Name: 1-(4-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Traditional Name: 1-(4-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CC1=NC2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C22H26N4O3/c1-16-24-20-15-17(22(27)23-9-10-25-11-13-29-14-12-25)3-8-21(20)26(16)18-4-6-19(28-2)7-5-18/h3-8,15H,9-14H2,1-2H3,(H,23,27)/p+1