2-cyano-N-[[3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]ethanamide

Systemtic Name: 2-cyano-N-[[3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]ethanamide Openeye Name: 2-cyano-N-[[3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]acetamide CAS Name: 2-cyano-N-[[3-methoxy-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]methyl]acetamide IUPAC Name: 2-cyano-N-[[3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]acetamide Traditional Name: 2-cyano-N-[3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzyl]acetamide Formula: C17H24N3O3+ MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC[NH+]2CCCC2)CNC(=O)CC#N

Isomeric SMILES

COC1=CC=CC(=C1OCC[NH+]2CCCC2)CNC(=O)CC#N

InChI

InChI=1S/C17H23N3O3/c1-22-15-6-4-5-14(13-19-16(21)7-8-18)17(15)23-12-11-20-9-2-3-10-20/h4-6H,2-3,7,9-13H2,1H3,(H,19,21)/p+1