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

Systemtic Name: 3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]propanoate Openeye Name: 3-[(5-methylisoxazol-3-yl)methylsulfonyl]propanoate CAS Name: 3-[(5-methyl-3-isoxazolyl)methylsulfonyl]propanoate IUPAC Name: 3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]propanoate Traditional Name: 3-[(5-methylisoxazol-3-yl)methylsulfonyl]propionate Formula: C8H10NO5S- MolecularWeight: 232.2337

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CS(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)CS(=O)(=O)CCC(=O)[O-]

InChI

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