2-[1-[4-chloranyl-2-(dimethylcarbamoyl)phenyl]propylsulfanyl]propanoic acid

Systemtic Name: 2-[1-[4-chloranyl-2-(dimethylcarbamoyl)phenyl]propylsulfanyl]propanoic acid Openeye Name: 2-[1-[4-chloro-2-(dimethylcarbamoyl)phenyl]propylsulfanyl]propanoic acid CAS Name: 2-[1-[4-chloro-2-[dimethylamino(oxo)methyl]phenyl]propylthio]propanoic acid IUPAC Name: 2-[1-[4-chloro-2-(dimethylcarbamoyl)phenyl]propylsulfanyl]propanoic acid Traditional Name: 2-[1-[4-chloro-2-(dimethylcarbamoyl)phenyl]propylthio]propionic acid Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C(C=C1)Cl)C(=O)N(C)C)SC(C)C(=O)O

Isomeric SMILES

CCC(C1=C(C=C(C=C1)Cl)C(=O)N(C)C)SC(C)C(=O)O

InChI

InChI=1S/C15H20ClNO3S/c1-5-13(21-9(2)15(19)20)11-7-6-10(16)8-12(11)14(18)17(3)4/h6-9,13H,5H2,1-4H3,(H,19,20)