2-(4-chloranylphenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-(1-pyrrolidin-1-iumylmethyl)-5-benzimidazolyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Formula: C21H24ClN4O2+ MolecularWeight: 399.89386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl)N=C1C[NH+]4CCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl)N=C1C[NH+]4CCCC4

InChI

InChI=1S/C21H23ClN4O2/c1-25-19-9-6-16(12-18(19)24-20(25)13-26-10-2-3-11-26)23-21(27)14-28-17-7-4-15(22)5-8-17/h4-9,12H,2-3,10-11,13-14H2,1H3,(H,23,27)/p+1