3-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[5-carbethoxy-2-(ethylamino)phenyl]sulfamoyl]benzoic acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O6S/c1-3-19-15-9-8-13(18(23)26-4-2)11-16(15)20-27(24,25)14-7-5-6-12(10-14)17(21)22/h5-11,19-20H,3-4H2,1-2H3,(H,21,22)