4-methyl-N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]benzamide

Systemtic Name: 4-methyl-N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]benzamide Openeye Name: 4-methyl-N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]benzamide CAS Name: 4-methyl-N-[1-methyl-2-(1-piperidin-1-iumylmethyl)-5-benzimidazolyl]benzamide IUPAC Name: 4-methyl-N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]benzamide Traditional Name: 4-methyl-N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]benzamide Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)C[NH+]4CCCCC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)C[NH+]4CCCCC4)C

InChI

InChI=1S/C22H26N4O/c1-16-6-8-17(9-7-16)22(27)23-18-10-11-20-19(14-18)24-21(25(20)2)15-26-12-4-3-5-13-26/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,23,27)/p+1