1-methyl-2-(piperidin-1-ium-1-ylmethyl)-N-(pyridin-4-ylmethyl)benzimidazol-5-amine

Systemtic Name: 1-methyl-2-(piperidin-1-ium-1-ylmethyl)-N-(pyridin-4-ylmethyl)benzimidazol-5-amine Openeye Name: 1-methyl-2-(piperidin-1-ium-1-ylmethyl)-N-(4-pyridylmethyl)benzimidazol-5-amine CAS Name: 1-methyl-2-(1-piperidin-1-iumylmethyl)-N-(pyridin-4-ylmethyl)-5-benzimidazolamine IUPAC Name: 1-methyl-2-(piperidin-1-ium-1-ylmethyl)-N-(pyridin-4-ylmethyl)benzimidazol-5-amine Traditional Name: [1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]-(4-pyridylmethyl)amine Formula: C20H26N5+ MolecularWeight: 336.45394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NCC3=CC=NC=C3)N=C1C[NH+]4CCCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NCC3=CC=NC=C3)N=C1C[NH+]4CCCCC4

InChI

InChI=1S/C20H25N5/c1-24-19-6-5-17(22-14-16-7-9-21-10-8-16)13-18(19)23-20(24)15-25-11-3-2-4-12-25/h5-10,13,22H,2-4,11-12,14-15H2,1H3/p+1