sodium 3-(4-hydroxyphenyl)-5,7-bis(oxidanyl)chromen-4-one dihydrate

Systemtic Name: sodium 3-(4-hydroxyphenyl)-5,7-bis(oxidanyl)chromen-4-one dihydrate Openeye Name: sodium 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one dihydrate CAS Name: sodium 5,7-dihydroxy-3-(4-hydroxyphenyl)-1-benzopyran-4-one dihydrate IUPAC Name: sodium 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one dihydrate Traditional Name: sodium 5,7-dihydroxy-3-(4-hydroxyphenyl)chromone dihydrate Formula: C15H14NaO7+ MolecularWeight: 329.25723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O.O.O.[Na+]

Isomeric SMILES

C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O.O.O.[Na+]

InChI

InChI=1S/C15H10O5.Na.2H2O/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19;;;/h1-7,16-18H;;2*1H2/q;+1;;