N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-indan-5-ylsulfanyl-acetamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-2-(2,3-dihydro-1H-inden-5-ylthio)acetamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-2-(indan-5-ylthio)acetamide Formula: C23H28ClN2OS+ MolecularWeight: 415.99922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCC(=O)NC3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCC(=O)NC3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H27ClN2OS/c24-20-7-4-17(5-8-20)15-26-12-10-21(11-13-26)25-23(27)16-28-22-9-6-18-2-1-3-19(18)14-22/h4-9,14,21H,1-3,10-13,15-16H2,(H,25,27)/p+1