disodium [2-oxidanyl-4-(2-oxidanylidenechromen-7-yl)oxy-butyl] phosphate

Systemtic Name: disodium [2-oxidanyl-4-(2-oxidanylidenechromen-7-yl)oxy-butyl] phosphate Openeye Name: disodium [2-hydroxy-4-(2-oxochromen-7-yl)oxy-butyl] phosphate CAS Name: disodium [2-hydroxy-4-[(2-oxo-1-benzopyran-7-yl)oxy]butyl] phosphate IUPAC Name: disodium [2-hydroxy-4-(2-oxochromen-7-yl)oxybutyl] phosphate Traditional Name: disodium [2-hydroxy-4-(2-ketochromen-7-yl)oxy-butyl] phosphate Formula: C13H13Na2O8P MolecularWeight: 374.190821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=O)O2)OCCC(COP(=O)([O-])[O-])O.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=O)O2)OCCC(COP(=O)([O-])[O-])O.[Na+].[Na+]

InChI

InChI=1S/C13H15O8P.2Na/c14-10(8-20-22(16,17)18)5-6-19-11-3-1-9-2-4-13(15)21-12(9)7-11;;/h1-4,7,10,14H,5-6,8H2,(H2,16,17,18);;/q;2*+1/p-2