(2-propanoylphenyl) 2-oxidanylidenechromene-6-sulfonate

Systemtic Name: (2-propanoylphenyl) 2-oxidanylidenechromene-6-sulfonate Openeye Name: (2-propanoylphenyl) 2-oxochromene-6-sulfonate CAS Name: 2-oxo-1-benzopyran-6-sulfonic acid [2-(1-oxopropyl)phenyl] ester IUPAC Name: (2-propanoylphenyl) 2-oxochromene-6-sulfonate Traditional Name: 2-ketochromene-6-sulfonic acid (2-propionylphenyl) ester Formula: C18H14O6S MolecularWeight: 358.36516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)OC(=O)C=C3

Isomeric SMILES

CCC(=O)C1=CC=CC=C1OS(=O)(=O)C2=CC3=C(C=C2)OC(=O)C=C3

InChI

InChI=1S/C18H14O6S/c1-2-15(19)14-5-3-4-6-17(14)24-25(21,22)13-8-9-16-12(11-13)7-10-18(20)23-16/h3-11H,2H2,1H3