3-phenyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-phenyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-phenyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-phenyl-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-phenyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-phenyl-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]propionamide Formula: C22H29N2O+ MolecularWeight: 337.47846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O/c25-22(14-13-19-9-3-1-4-10-19)23-17-20-11-5-6-12-21(20)18-24-15-7-2-8-16-24/h1,3-6,9-12H,2,7-8,13-18H2,(H,23,25)/p+1