2-cyano-N-[2-[3-methoxy-2-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC[NH+]2CCCCC2)CCNC(=O)CC#N

Isomeric SMILES

COC1=CC=CC(=C1OCC[NH+]2CCCCC2)CCNC(=O)CC#N

InChI

InChI=1S/C19H27N3O3/c1-24-17-7-5-6-16(9-11-21-18(23)8-10-20)19(17)25-15-14-22-12-3-2-4-13-22/h5-7H,2-4,8-9,11-15H2,1H3,(H,21,23)/p+1