N-(2-morpholin-4-ium-4-ylethyl)-1-(3,4,5-trimethoxyphenyl)benzimidazole-5-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-1-(3,4,5-trimethoxyphenyl)benzimidazole-5-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-1-(3,4,5-trimethoxyphenyl)benzimidazole-5-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-1-(3,4,5-trimethoxyphenyl)-5-benzimidazolecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-1-(3,4,5-trimethoxyphenyl)benzimidazole-5-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-1-(3,4,5-trimethoxyphenyl)benzimidazole-5-carboxamide Formula: C23H29N4O5+ MolecularWeight: 441.50016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2C=NC3=C2C=CC(=C3)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2C=NC3=C2C=CC(=C3)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C23H28N4O5/c1-29-20-13-17(14-21(30-2)22(20)31-3)27-15-25-18-12-16(4-5-19(18)27)23(28)24-6-7-26-8-10-32-11-9-26/h4-5,12-15H,6-11H2,1-3H3,(H,24,28)/p+1