3-cyano-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-cyano-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-cyano-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-cyano-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-cyano-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-cyano-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C21H24N3O+ MolecularWeight: 334.43476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O/c22-14-19-5-4-6-20(13-19)21(25)23-15-17-7-9-18(10-8-17)16-24-11-2-1-3-12-24/h4-10,13H,1-3,11-12,15-16H2,(H,23,25)/p+1