2-[3-[(2-chlorophenyl)methylsulfanyl]propanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[(2-chlorophenyl)methylsulfanyl]propanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[3-[(2-chlorophenyl)methylsulfanyl]propanoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[3-[(2-chlorophenyl)methylthio]-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[3-[(2-chlorophenyl)methylsulfanyl]propanoylamino]ethyl-dimethylazanium Traditional Name: 2-[3-[(2-chlorobenzyl)thio]propanoylamino]ethyl-dimethyl-ammonium Formula: C14H22ClN2OS+ MolecularWeight: 301.85528

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CCSCC1=CC=CC=C1Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)CCSCC1=CC=CC=C1Cl

InChI

InChI=1S/C14H21ClN2OS/c1-17(2)9-8-16-14(18)7-10-19-11-12-5-3-4-6-13(12)15/h3-6H,7-11H2,1-2H3,(H,16,18)/p+1