(1-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl) hydrogen sulfate

Systemtic Name: (1-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl) hydrogen sulfate Openeye Name: (1-methyl-4-oxo-cyclohexa-2,5-dien-1-yl) hydrogen sulfate CAS Name: sulfuric acid (1-methyl-4-oxo-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-methyl-4-oxocyclohexa-2,5-dien-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (4-keto-1-methyl-cyclohexa-2,5-dien-1-yl) ester Formula: C7H8O5S MolecularWeight: 204.20042

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=O)C=C1)OS(=O)(=O)O

Isomeric SMILES

CC1(C=CC(=O)C=C1)OS(=O)(=O)O

InChI

InChI=1S/C7H8O5S/c1-7(12-13(9,10)11)4-2-6(8)3-5-7/h2-5H,1H3,(H,9,10,11)