(3-ethanoylphenyl) 2-oxidanylidenechromene-6-sulfonate

Systemtic Name: (3-ethanoylphenyl) 2-oxidanylidenechromene-6-sulfonate Openeye Name: (3-acetylphenyl) 2-oxochromene-6-sulfonate CAS Name: 2-oxo-1-benzopyran-6-sulfonic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 2-oxochromene-6-sulfonate Traditional Name: 2-ketochromene-6-sulfonic acid (3-acetylphenyl) ester Formula: C17H12O6S MolecularWeight: 344.33858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC3=C(C=C2)OC(=O)C=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OS(=O)(=O)C2=CC3=C(C=C2)OC(=O)C=C3

InChI

InChI=1S/C17H12O6S/c1-11(18)12-3-2-4-14(9-12)23-24(20,21)15-6-7-16-13(10-15)5-8-17(19)22-16/h2-10H,1H3