(4,7-dimethyl-2-oxidanylidene-chromen-6-yl) propane-1-sulfonate

Systemtic Name: (4,7-dimethyl-2-oxidanylidene-chromen-6-yl) propane-1-sulfonate Openeye Name: (4,7-dimethyl-2-oxo-chromen-6-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (4,7-dimethyl-2-oxochromen-6-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (2-keto-4,7-dimethyl-chromen-6-yl) ester Formula: C14H16O5S MolecularWeight: 296.33884

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)OC1=C(C=C2C(=C1)C(=CC(=O)O2)C)C

Isomeric SMILES

CCCS(=O)(=O)OC1=C(C=C2C(=C1)C(=CC(=O)O2)C)C

InChI

InChI=1S/C14H16O5S/c1-4-5-20(16,17)19-12-8-11-9(2)7-14(15)18-13(11)6-10(12)3/h6-8H,4-5H2,1-3H3