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

Systemtic Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]ethanamide Openeye Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide CAS Name: N-[1-methyl-2-(1-piperidin-1-iumylmethyl)-5-benzimidazolyl]acetamide IUPAC Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Traditional Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Formula: C16H23N4O+ MolecularWeight: 287.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCCCC3)C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C16H22N4O/c1-12(21)17-13-6-7-15-14(10-13)18-16(19(15)2)11-20-8-4-3-5-9-20/h6-7,10H,3-5,8-9,11H2,1-2H3,(H,17,21)/p+1