N-(2-methylsulfanylphenyl)-1-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-methylsulfanylphenyl)-1-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-benzyl-N-(2-methylsulfanylphenyl)piperidin-1-ium-4-carboxamide CAS Name: N-[2-(methylthio)phenyl]-1-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-benzyl-N-(2-methylsulfanylphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-benzyl-N-[2-(methylthio)phenyl]piperidin-1-ium-4-carboxamide Formula: C20H25N2OS+ MolecularWeight: 341.4903

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2OS/c1-24-19-10-6-5-9-18(19)21-20(23)17-11-13-22(14-12-17)15-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3,(H,21,23)/p+1