3-[4-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[5-ethoxycarbonyl-2-(ethylamino)phenyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[5-carbethoxy-2-(ethylamino)phenyl]sulfamoyl]phenyl]propionic acid Formula: C20H24N2O6S MolecularWeight: 420.47936

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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)CCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O6S/c1-3-21-17-11-8-15(20(25)28-4-2)13-18(17)22-29(26,27)16-9-5-14(6-10-16)7-12-19(23)24/h5-6,8-11,13,21-22H,3-4,7,12H2,1-2H3,(H,23,24)