2-[[3-(dimethylsulfamoyl)-4-methoxy-phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[3-(dimethylsulfamoyl)-4-methoxy-phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[3-(dimethylsulfamoyl)-4-methoxy-benzoyl]amino]terephthalic acid CAS Name: 2-[[[3-(dimethylsulfamoyl)-4-methoxyphenyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[3-(dimethylsulfamoyl)-4-methoxybenzoyl]amino]terephthalic acid Traditional Name: 2-[[3-(dimethylsulfamoyl)-4-methoxy-benzoyl]amino]terephthalic acid Formula: C18H18N2O8S MolecularWeight: 422.40912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C18H18N2O8S/c1-20(2)29(26,27)15-9-10(5-7-14(15)28-3)16(21)19-13-8-11(17(22)23)4-6-12(13)18(24)25/h4-9H,1-3H3,(H,19,21)(H,22,23)(H,24,25)