1-[(2-chlorophenyl)-methylsulfanyl-methylidene]piperidin-1-ium iodide

Systemtic Name: 1-[(2-chlorophenyl)-methylsulfanyl-methylidene]piperidin-1-ium iodide Openeye Name: 1-[(2-chlorophenyl)-methylsulfanyl-methylene]piperidin-1-ium iodide CAS Name: 1-[(2-chlorophenyl)-(methylthio)methylidene]piperidin-1-ium iodide IUPAC Name: 1-[(2-chlorophenyl)-methylsulfanylmethylidene]piperidin-1-ium iodide Traditional Name: 1-[(2-chlorophenyl)-(methylthio)methylene]piperidin-1-ium iodide Formula: C13H17ClINS MolecularWeight: 381.70325

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=[N+]1CCCCC1)C2=CC=CC=C2Cl.[I-]

Isomeric SMILES

CSC(=[N+]1CCCCC1)C2=CC=CC=C2Cl.[I-]

InChI

InChI=1S/C13H17ClNS.HI/c1-16-13(15-9-5-2-6-10-15)11-7-3-4-8-12(11)14;/h3-4,7-8H,2,5-6,9-10H2,1H3;1H/q+1;/p-1