1-(nonoxymethyl)-3-(2-piperidin-1-ylethyl)benzimidazol-1-ium chloride

Systemtic Name: 1-(nonoxymethyl)-3-(2-piperidin-1-ylethyl)benzimidazol-1-ium chloride Openeye Name: 1-(nonoxymethyl)-3-[2-(1-piperidyl)ethyl]benzimidazol-1-ium chloride CAS Name: 1-(nonoxymethyl)-3-[2-(1-piperidinyl)ethyl]benzimidazol-1-ium chloride IUPAC Name: 1-(nonoxymethyl)-3-(2-piperidin-1-ylethyl)benzimidazol-1-ium chloride Traditional Name: 1-(nonoxymethyl)-3-(2-piperidinoethyl)benzimidazol-1-ium chloride Formula: C24H40ClN3O MolecularWeight: 422.0469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC[N+]1=CN(C2=CC=CC=C21)CCN3CCCCC3.[Cl-]

Isomeric SMILES

CCCCCCCCCOC[N+]1=CN(C2=CC=CC=C21)CCN3CCCCC3.[Cl-]

InChI

InChI=1S/C24H40N3O.ClH/c1-2-3-4-5-6-7-13-20-28-22-27-21-26(23-14-9-10-15-24(23)27)19-18-25-16-11-8-12-17-25;/h9-10,14-15,21H,2-8,11-13,16-20,22H2,1H3;1H/q+1;/p-1