N-(2-methylsulfanylethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-(2-methylsulfanylethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-(2-methylsulfanylethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[2-(methylthio)ethyl]-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-(2-methylsulfanylethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[2-(methylthio)ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C23H31N2O2S+ MolecularWeight: 399.56944

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

CSCCNC(=O)C1=CC=C(C=C1)OC2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O2S/c1-28-18-14-24-23(26)20-7-9-21(10-8-20)27-22-12-16-25(17-13-22)15-11-19-5-3-2-4-6-19/h2-10,22H,11-18H2,1H3,(H,24,26)/p+1