3-[[5-(diethylsulfamoyl)-2-(2-hydroxyethylamino)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[[5-(diethylsulfamoyl)-2-(2-hydroxyethylamino)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[[5-(diethylsulfamoyl)-2-(2-hydroxyethylamino)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[[5-(diethylsulfamoyl)-2-(2-hydroxyethylamino)phenyl]sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[[5-(diethylsulfamoyl)-2-(2-hydroxyethylamino)phenyl]sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[[5-(diethylsulfamoyl)-2-(2-hydroxyethylamino)phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C21H29N3O7S2 MolecularWeight: 499.60086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCO)NS(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCCO)NS(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)O

InChI

InChI=1S/C21H29N3O7S2/c1-5-24(6-2)33(30,31)17-7-8-18(22-9-10-25)19(13-17)23-32(28,29)20-12-16(21(26)27)11-14(3)15(20)4/h7-8,11-13,22-23,25H,5-6,9-10H2,1-4H3,(H,26,27)