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

Systemtic Name: 3-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]benzoic acid Formula: C17H21N3O6S2 MolecularWeight: 427.49514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C17H21N3O6S2/c1-4-18-15-9-8-14(28(25,26)20(2)3)11-16(15)19-27(23,24)13-7-5-6-12(10-13)17(21)22/h5-11,18-19H,4H2,1-3H3,(H,21,22)