N'-(1,3-benzodioxol-5-ylmethyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]ethanediamide

Systemtic Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]ethanediamide Openeye Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]oxamide CAS Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[[1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl]oxamide IUPAC Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]oxamide Traditional Name: N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-N'-piperonyl-oxamide Formula: C19H28N3O5+ MolecularWeight: 378.44272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCC(CC1)CNC(=O)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COCC[NH+]1CCC(CC1)CNC(=O)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H27N3O5/c1-25-9-8-22-6-4-14(5-7-22)11-20-18(23)19(24)21-12-15-2-3-16-17(10-15)27-13-26-16/h2-3,10,14H,4-9,11-13H2,1H3,(H,20,23)(H,21,24)/p+1