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

Systemtic Name: 2,4-dimethyl-5-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]benzoic acid Openeye Name: 2,4-dimethyl-5-[(3-methylisoxazol-5-yl)methylsulfonyl]benzoic acid CAS Name: 2,4-dimethyl-5-[(3-methyl-5-isoxazolyl)methylsulfonyl]benzoic acid IUPAC Name: 2,4-dimethyl-5-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]benzoic acid Traditional Name: 2,4-dimethyl-5-[(3-methylisoxazol-5-yl)methylsulfonyl]benzoic acid Formula: C14H15NO5S MolecularWeight: 309.3376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)CC2=CC(=NO2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)CC2=CC(=NO2)C)C

InChI

InChI=1S/C14H15NO5S/c1-8-4-9(2)13(6-12(8)14(16)17)21(18,19)7-11-5-10(3)15-20-11/h4-6H,7H2,1-3H3,(H,16,17)