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

Systemtic Name: 2-cyano-N-[2-[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]ethanamide Openeye Name: 2-cyano-N-[2-[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]acetamide CAS Name: 2-cyano-N-[2-[3-ethoxy-4-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]ethyl]acetamide IUPAC Name: 2-cyano-N-[2-[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]acetamide Traditional Name: 2-cyano-N-[2-[3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethyl]acetamide Formula: C20H30N3O3+ MolecularWeight: 360.4705

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O3/c1-2-25-19-16-17(9-11-22-20(24)8-10-21)6-7-18(19)26-15-14-23-12-4-3-5-13-23/h6-7,16H,2-5,8-9,11-15H2,1H3,(H,22,24)/p+1