N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3-thiophen-2-yl-propanamide

Systemtic Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3-thiophen-2-yl-propanamide Openeye Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3-(2-thienyl)propanamide CAS Name: N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-3-thiophen-2-ylpropanamide IUPAC Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3-thiophen-2-ylpropanamide Traditional Name: N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]-3-(2-thienyl)propionamide Formula: C20H27N2OS+ MolecularWeight: 343.50618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCC3=CC=CS3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCC3=CC=CS3

InChI

InChI=1S/C20H26N2OS/c23-20(11-10-19-5-4-14-24-19)21-15-17-6-8-18(9-7-17)16-22-12-2-1-3-13-22/h4-9,14H,1-3,10-13,15-16H2,(H,21,23)/p+1