2-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]ethanoic acid

Systemtic Name: 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]ethanoic acid Openeye Name: 2-[(3-methylisoxazol-5-yl)methylsulfonyl]acetic acid CAS Name: 2-[(3-methyl-5-isoxazolyl)methylsulfonyl]acetic acid IUPAC Name: 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]acetic acid Traditional Name: 2-[(3-methylisoxazol-5-yl)methylsulfonyl]acetic acid Formula: C7H9NO5S MolecularWeight: 219.21506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CS(=O)(=O)CC(=O)O

Isomeric SMILES

CC1=NOC(=C1)CS(=O)(=O)CC(=O)O

InChI

InChI=1S/C7H9NO5S/c1-5-2-6(13-8-5)3-14(11,12)4-7(9)10/h2H,3-4H2,1H3,(H,9,10)