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

Systemtic Name: 3-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]propanoic acid Openeye Name: 3-[(3-methylisoxazol-5-yl)methylsulfonyl]propanoic acid CAS Name: 3-[(3-methyl-5-isoxazolyl)methylsulfonyl]propanoic acid IUPAC Name: 3-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]propanoic acid Traditional Name: 3-[(3-methylisoxazol-5-yl)methylsulfonyl]propionic acid Formula: C8H11NO5S MolecularWeight: 233.24164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11NO5S/c1-6-4-7(14-9-6)5-15(12,13)3-2-8(10)11/h4H,2-3,5H2,1H3,(H,10,11)