N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]naphthalene-1-carboxamide

Systemtic Name: N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]naphthalene-1-carboxamide Openeye Name: N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]naphthalene-1-carboxamide CAS Name: N-[[(3R)-1-[3-(methylthio)propyl]-3-piperidin-1-iumyl]methyl]-1-naphthalenecarboxamide IUPAC Name: N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]naphthalene-1-carboxamide Traditional Name: N-[[(3R)-1-[3-(methylthio)propyl]piperidin-1-ium-3-yl]methyl]-1-naphthamide Formula: C21H29N2OS+ MolecularWeight: 357.53276

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH+]1CCCC(C1)CNC(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CSCCC[NH+]1CCC[C@@H](C1)CNC(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H28N2OS/c1-25-14-6-13-23-12-5-7-17(16-23)15-22-21(24)20-11-4-9-18-8-2-3-10-19(18)20/h2-4,8-11,17H,5-7,12-16H2,1H3,(H,22,24)/p+1/t17-/m1/s1