2-[3-chloranyl-4-(dimethylcarbamoylsulfanyl)phenyl]ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-(dimethylcarbamoylsulfanyl)phenyl]ethanoic acid Openeye Name: 2-[3-chloro-4-(dimethylcarbamoylsulfanyl)phenyl]acetic acid CAS Name: 2-[3-chloro-4-[[dimethylamino(oxo)methyl]thio]phenyl]acetic acid IUPAC Name: 2-[3-chloro-4-(dimethylcarbamoylsulfanyl)phenyl]acetic acid Traditional Name: 2-[3-chloro-4-(dimethylcarbamoylthio)phenyl]acetic acid Formula: C11H12ClNO3S MolecularWeight: 273.73588

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=C(C=C(C=C1)CC(=O)O)Cl

Isomeric SMILES

CN(C)C(=O)SC1=C(C=C(C=C1)CC(=O)O)Cl

InChI

InChI=1S/C11H12ClNO3S/c1-13(2)11(16)17-9-4-3-7(5-8(9)12)6-10(14)15/h3-5H,6H2,1-2H3,(H,14,15)