(6-tert-butyl-3-oxidanylidene-isoindol-1-yl) hydrogen sulfate

Systemtic Name: (6-tert-butyl-3-oxidanylidene-isoindol-1-yl) hydrogen sulfate Openeye Name: (6-tert-butyl-3-oxo-isoindol-1-yl) hydrogen sulfate CAS Name: sulfuric acid (6-tert-butyl-3-oxo-1-isoindolyl) ester IUPAC Name: (6-tert-butyl-3-oxoisoindol-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (6-tert-butyl-3-keto-isoindol-1-yl) ester Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C(=O)N=C2OS(=O)(=O)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C(=O)N=C2OS(=O)(=O)O

InChI

InChI=1S/C12H13NO5S/c1-12(2,3)7-4-5-8-9(6-7)11(13-10(8)14)18-19(15,16)17/h4-6H,1-3H3,(H,15,16,17)