4-chloranyl-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzamide

Systemtic Name: 4-chloranyl-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzamide Openeye Name: 4-chloro-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzamide CAS Name: 4-chloro-N-[1-methyl-2-[2-(1-pyrrolidin-1-iumyl)ethyl]-5-benzimidazolyl]benzamide IUPAC Name: 4-chloro-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzamide Traditional Name: 4-chloro-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzamide Formula: C21H24ClN4O+ MolecularWeight: 383.89446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)N=C1CC[NH+]4CCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)N=C1CC[NH+]4CCCC4

InChI

InChI=1S/C21H23ClN4O/c1-25-19-9-8-17(23-21(27)15-4-6-16(22)7-5-15)14-18(19)24-20(25)10-13-26-11-2-3-12-26/h4-9,14H,2-3,10-13H2,1H3,(H,23,27)/p+1