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

Systemtic Name: 2-[[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid Formula: C19H17N3O6S MolecularWeight: 415.41978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H17N3O6S/c1-11-12(2)21-28-18(11)22-29(26,27)14-9-7-13(8-10-14)20-17(23)15-5-3-4-6-16(15)19(24)25/h3-10,22H,1-2H3,(H,20,23)(H,24,25)