1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[[4-(methylthio)phenyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-methylsulfanylphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[4-(methylthio)benzyl]piperidin-1-ium-4-carboxamide Formula: C14H21N2OS+ MolecularWeight: 265.39434

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C14H20N2OS/c1-18-13-4-2-11(3-5-13)10-16-8-6-12(7-9-16)14(15)17/h2-5,12H,6-10H2,1H3,(H2,15,17)/p+1