2-oxidanylidene-3-propan-2-yl-1,3-benzoxazole-6-sulfonic acid

Systemtic Name: 2-oxidanylidene-3-propan-2-yl-1,3-benzoxazole-6-sulfonic acid Openeye Name: 3-isopropyl-2-oxo-1,3-benzoxazole-6-sulfonic acid CAS Name: 2-oxo-3-propan-2-yl-1,3-benzoxazole-6-sulfonic acid IUPAC Name: 2-oxo-3-propan-2-yl-1,3-benzoxazole-6-sulfonic acid Traditional Name: 3-isopropyl-2-keto-1,3-benzoxazole-6-sulfonic acid Formula: C10H11NO5S MolecularWeight: 257.26304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)O)OC1=O

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)O)OC1=O

InChI

InChI=1S/C10H11NO5S/c1-6(2)11-8-4-3-7(17(13,14)15)5-9(8)16-10(11)12/h3-6H,1-2H3,(H,13,14,15)