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

Systemtic Name: 1-(3,5-dimethylphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Openeye Name: 1-(3,5-dimethylphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide CAS Name: 1-(3,5-dimethylphenyl)-2-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-5-benzimidazolecarboxamide IUPAC Name: 1-(3,5-dimethylphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Traditional Name: 1-(3,5-dimethylphenyl)-2-methyl-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NC3=C2C=CC(=C3)C(=O)NCC[NH+]4CCOCC4)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NC3=C2C=CC(=C3)C(=O)NCC[NH+]4CCOCC4)C)C

InChI

InChI=1S/C23H28N4O2/c1-16-12-17(2)14-20(13-16)27-18(3)25-21-15-19(4-5-22(21)27)23(28)24-6-7-26-8-10-29-11-9-26/h4-5,12-15H,6-11H2,1-3H3,(H,24,28)/p+1