N-[4-(cyanomethyl)phenyl]-2-(4-methylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-(4-methylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(4-methylpiperidin-1-ium-1-yl)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(4-methyl-1-piperidin-1-iumyl)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(4-methylpiperidin-1-ium-1-yl)acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(4-methylpiperidin-1-ium-1-yl)acetamide Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)CC#N

Isomeric SMILES

CC1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C16H21N3O/c1-13-7-10-19(11-8-13)12-16(20)18-15-4-2-14(3-5-15)6-9-17/h2-5,13H,6-8,10-12H2,1H3,(H,18,20)/p+1