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

Systemtic Name: 4-chloranyl-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzamide Openeye Name: 4-chloro-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzamide CAS Name: 4-chloro-N-[1-methyl-2-[2-(4-morpholin-4-iumyl)ethyl]-5-benzimidazolyl]benzamide IUPAC Name: 4-chloro-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzamide Traditional Name: 4-chloro-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzamide Formula: C21H24ClN4O2+ MolecularWeight: 399.89386

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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+]4CCOCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)N=C1CC[NH+]4CCOCC4

InChI

InChI=1S/C21H23ClN4O2/c1-25-19-7-6-17(23-21(27)15-2-4-16(22)5-3-15)14-18(19)24-20(25)8-9-26-10-12-28-13-11-26/h2-7,14H,8-13H2,1H3,(H,23,27)/p+1