5-oxidanyl-2-oxidanylidene-4-propyl-chromene-7-sulfonic acid

Systemtic Name: 5-oxidanyl-2-oxidanylidene-4-propyl-chromene-7-sulfonic acid Openeye Name: 5-hydroxy-2-oxo-4-propyl-chromene-7-sulfonic acid CAS Name: 5-hydroxy-2-oxo-4-propyl-1-benzopyran-7-sulfonic acid IUPAC Name: 5-hydroxy-2-oxo-4-propylchromene-7-sulfonic acid Traditional Name: 5-hydroxy-2-keto-4-propyl-chromene-7-sulfonic acid Formula: C12H12O6S MolecularWeight: 284.28508

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=CC(=C12)O)S(=O)(=O)O

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=CC(=C12)O)S(=O)(=O)O

InChI

InChI=1S/C12H12O6S/c1-2-3-7-4-11(14)18-10-6-8(19(15,16)17)5-9(13)12(7)10/h4-6,13H,2-3H2,1H3,(H,15,16,17)