(4,5-diethyl-6-oxidanyl-2-oxidanylidene-chromen-3-yl)phosphonic acid

Systemtic Name: (4,5-diethyl-6-oxidanyl-2-oxidanylidene-chromen-3-yl)phosphonic acid Openeye Name: (4,5-diethyl-6-hydroxy-2-oxo-chromen-3-yl)phosphonic acid CAS Name: (4,5-diethyl-6-hydroxy-2-oxo-1-benzopyran-3-yl)phosphonic acid IUPAC Name: (4,5-diethyl-6-hydroxy-2-oxochromen-3-yl)phosphonic acid Traditional Name: (4,5-diethyl-6-hydroxy-2-keto-chromen-3-yl)phosphonic acid Formula: C13H15O6P MolecularWeight: 298.228361

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC2=C1C(=C(C(=O)O2)P(=O)(O)O)CC)O

Isomeric SMILES

CCC1=C(C=CC2=C1C(=C(C(=O)O2)P(=O)(O)O)CC)O

InChI

InChI=1S/C13H15O6P/c1-3-7-9(14)5-6-10-11(7)8(4-2)12(13(15)19-10)20(16,17)18/h5-6,14H,3-4H2,1-2H3,(H2,16,17,18)