1-[[4-(2-cyanophenyl)phenyl]methyl]-N-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[4-(2-cyanophenyl)benzyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C21H24N3O+ MolecularWeight: 334.43476

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CNC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C21H23N3O/c1-23-21(25)18-10-12-24(13-11-18)15-16-6-8-17(9-7-16)20-5-3-2-4-19(20)14-22/h2-9,18H,10-13,15H2,1H3,(H,23,25)/p+1