3-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]sulfamoyl]benzoic acid Formula: C17H15N3O7S2 MolecularWeight: 437.4469

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H15N3O7S2/c1-11-9-16(18-27-11)20-28(23,24)14-7-5-13(6-8-14)19-29(25,26)15-4-2-3-12(10-15)17(21)22/h2-10,19H,1H3,(H,18,20)(H,21,22)