N-[2-[5-chloranyl-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]-2-cyano-ethanamide

Systemtic Name: N-[2-[5-chloranyl-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]-2-cyano-ethanamide Openeye Name: N-[2-[5-chloro-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]-2-cyano-acetamide CAS Name: N-[2-[5-chloro-2-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]ethyl]-2-cyanoacetamide IUPAC Name: N-[2-[5-chloro-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]-2-cyanoacetamide Traditional Name: N-[2-[5-chloro-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]-2-cyano-acetamide Formula: C18H25ClN3O2+ MolecularWeight: 350.863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCOC2=C(C=C(C=C2)Cl)CCNC(=O)CC#N

Isomeric SMILES

C1CC[NH+](CC1)CCOC2=C(C=C(C=C2)Cl)CCNC(=O)CC#N

InChI

InChI=1S/C18H24ClN3O2/c19-16-4-5-17(24-13-12-22-10-2-1-3-11-22)15(14-16)7-9-21-18(23)6-8-20/h4-5,14H,1-3,6-7,9-13H2,(H,21,23)/p+1