N-cyclooctyl-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-cyclooctyl-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-cyclooctyl-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-cyclooctyl-3-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-cyclooctyl-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-cyclooctyl-3-[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C26H43N3O2+2 MolecularWeight: 429.63852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NC4CCCCCCC4

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NC4CCCCCCC4

InChI

InChI=1S/C26H41N3O2/c1-28-16-12-23(13-17-28)29-18-14-24(15-19-29)31-25-11-7-8-21(20-25)26(30)27-22-9-5-3-2-4-6-10-22/h7-8,11,20,22-24H,2-6,9-10,12-19H2,1H3,(H,27,30)/p+2