5-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid

Systemtic Name: 5-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid Openeye Name: 5-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid CAS Name: 5-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]-2-methylbenzoic acid IUPAC Name: 5-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]-2-methylbenzoic acid Traditional Name: 5-[[5-carbethoxy-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)OCC)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)O

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)OCC)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)O

InChI

InChI=1S/C19H22N2O6S/c1-4-20-16-9-7-13(19(24)27-5-2)10-17(16)21-28(25,26)14-8-6-12(3)15(11-14)18(22)23/h6-11,20-21H,4-5H2,1-3H3,(H,22,23)