3-methyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]benzoic acid

Systemtic Name: 3-methyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]benzoic acid Openeye Name: 3-methyl-2-[(5-methylisoxazol-3-yl)methylsulfonylamino]benzoic acid CAS Name: 3-methyl-2-[(5-methyl-3-isoxazolyl)methylsulfonylamino]benzoic acid IUPAC Name: 3-methyl-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]benzoic acid Traditional Name: 3-methyl-2-[(5-methylisoxazol-3-yl)methylsulfonylamino]benzoic acid Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NS(=O)(=O)CC2=NOC(=C2)C)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1NS(=O)(=O)CC2=NOC(=C2)C)C(=O)O

InChI

InChI=1S/C13H14N2O5S/c1-8-4-3-5-11(13(16)17)12(8)15-21(18,19)7-10-6-9(2)20-14-10/h3-6,15H,7H2,1-2H3,(H,16,17)