3-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]propanoic acid

Systemtic Name: 3-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]propanoic acid Openeye Name: 3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanoic acid CAS Name: 3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanoic acid IUPAC Name: 3-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]propanoic acid Traditional Name: 3-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]propionic acid Formula: C11H11NO6S MolecularWeight: 285.27314

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)O)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)O)OC1=O

InChI

InChI=1S/C11H11NO6S/c1-12-8-3-2-7(6-9(8)18-11(12)15)19(16,17)5-4-10(13)14/h2-3,6H,4-5H2,1H3,(H,13,14)