3-[(S)-(4-methylphenyl)sulfinyl]-1-propyl-pyridin-1-ium chloride

Systemtic Name: 3-[(S)-(4-methylphenyl)sulfinyl]-1-propyl-pyridin-1-ium chloride Openeye Name: 1-propyl-3-[(S)-p-tolylsulfinyl]pyridin-1-ium chloride CAS Name: 3-[(S)-(4-methylphenyl)sulfinyl]-1-propylpyridin-1-ium chloride IUPAC Name: 3-[(S)-(4-methylphenyl)sulfinyl]-1-propylpyridin-1-ium chloride Traditional Name: 1-propyl-3-[(S)-p-tolylsulfinyl]pyridin-1-ium chloride Formula: C15H18ClNOS MolecularWeight: 295.82752

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC=CC(=C1)S(=O)C2=CC=C(C=C2)C.[Cl-]

Isomeric SMILES

CCC[N+]1=CC=CC(=C1)[S@@](=O)C2=CC=C(C=C2)C.[Cl-]

InChI

InChI=1S/C15H18NOS.ClH/c1-3-10-16-11-4-5-15(12-16)18(17)14-8-6-13(2)7-9-14;/h4-9,11-12H,3,10H2,1-2H3;1H/q+1;/p-1/t18-;/m0./s1