3-(4-chloranyl-2-methylsulfanyl-phenyl)propylazanium

Systemtic Name: 3-(4-chloranyl-2-methylsulfanyl-phenyl)propylazanium Openeye Name: 3-(4-chloro-2-methylsulfanyl-phenyl)propylammonium CAS Name: 3-[4-chloro-2-(methylthio)phenyl]propylammonium IUPAC Name: 3-(4-chloro-2-methylsulfanylphenyl)propylazanium Traditional Name: 3-[4-chloro-2-(methylthio)phenyl]propylammonium Formula: C10H15ClNS+ MolecularWeight: 216.7508

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1)Cl)CCC[NH3+]

Isomeric SMILES

CSC1=C(C=CC(=C1)Cl)CCC[NH3+]

InChI

InChI=1S/C10H14ClNS/c1-13-10-7-9(11)5-4-8(10)3-2-6-12/h4-5,7H,2-3,6,12H2,1H3/p+1