5-chloranyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline

Systemtic Name: 5-chloranyl-2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline Openeye Name: 5-chloro-2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline CAS Name: 5-chloro-2-[2-(1-piperidin-1-iumyl)ethylthio]aniline IUPAC Name: 5-chloro-2-(2-piperidin-1-ium-1-ylethylsulfanyl)aniline Traditional Name: [5-chloro-2-(2-piperidin-1-ium-1-ylethylthio)phenyl]amine Formula: C13H20ClN2S+ MolecularWeight: 271.8293

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCSC2=C(C=C(C=C2)Cl)N

Isomeric SMILES

C1CC[NH+](CC1)CCSC2=C(C=C(C=C2)Cl)N

InChI

InChI=1S/C13H19ClN2S/c14-11-4-5-13(12(15)10-11)17-9-8-16-6-2-1-3-7-16/h4-5,10H,1-3,6-9,15H2/p+1