2-cyano-N-[[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]ethanamide

Systemtic Name: 2-cyano-N-[[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]ethanamide Openeye Name: 2-cyano-N-[[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]acetamide CAS Name: 2-cyano-N-[[3-ethoxy-4-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]methyl]acetamide IUPAC Name: 2-cyano-N-[[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]acetamide Traditional Name: 2-cyano-N-[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzyl]acetamide Formula: C19H28N3O3+ MolecularWeight: 346.44392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC(=O)CC#N)OCC[NH+]2CCCCC2

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC(=O)CC#N)OCC[NH+]2CCCCC2

InChI

InChI=1S/C19H27N3O3/c1-2-24-18-14-16(15-21-19(23)8-9-20)6-7-17(18)25-13-12-22-10-4-3-5-11-22/h6-7,14H,2-5,8,10-13,15H2,1H3,(H,21,23)/p+1