2-(3-methylphenoxy)-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]ethanamide

Systemtic Name: 2-(3-methylphenoxy)-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]ethanamide Openeye Name: 2-(3-methylphenoxy)-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]acetamide CAS Name: 2-(3-methylphenoxy)-N-[1-methyl-2-[2-(1-pyrrolidin-1-iumyl)ethyl]-5-benzimidazolyl]acetamide IUPAC Name: 2-(3-methylphenoxy)-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]acetamide Traditional Name: 2-(3-methylphenoxy)-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]acetamide Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCCC4)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCCC4)C

InChI

InChI=1S/C23H28N4O2/c1-17-6-5-7-19(14-17)29-16-23(28)24-18-8-9-21-20(15-18)25-22(26(21)2)10-13-27-11-3-4-12-27/h5-9,14-15H,3-4,10-13,16H2,1-2H3,(H,24,28)/p+1