5-(dimethylcarbamoylsulfanyl)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(dimethylcarbamoylsulfanyl)benzene-1,3-dicarboxylic acid Openeye Name: 5-(dimethylcarbamoylsulfanyl)benzene-1,3-dicarboxylic acid CAS Name: 5-[[dimethylamino(oxo)methyl]thio]benzene-1,3-dicarboxylic acid IUPAC Name: 5-(dimethylcarbamoylsulfanyl)benzene-1,3-dicarboxylic acid Traditional Name: 5-(dimethylcarbamoylthio)isophthalic acid Formula: C11H11NO5S MolecularWeight: 269.27374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO5S/c1-12(2)11(17)18-8-4-6(9(13)14)3-7(5-8)10(15)16/h3-5H,1-2H3,(H,13,14)(H,15,16)