N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-thiophen-2-ylcarbonyl-benzamide

Systemtic Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-thiophen-2-ylcarbonyl-benzamide Openeye Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(thiophene-2-carbonyl)benzamide CAS Name: 2-[oxo(thiophen-2-yl)methyl]-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(thiophene-2-carbonyl)benzamide Traditional Name: N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]-2-(2-thenoyl)benzamide Formula: C25H27N2O2S+ MolecularWeight: 419.55908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

InChI

InChI=1S/C25H26N2O2S/c28-24(23-13-8-16-30-23)21-11-4-5-12-22(21)25(29)26-17-19-9-2-3-10-20(19)18-27-14-6-1-7-15-27/h2-5,8-13,16H,1,6-7,14-15,17-18H2,(H,26,29)/p+1