sodium 4-[4-[5,7-bis(oxidanyl)-4-oxidanylidene-2,3-dihydrochromen-2-yl]phenoxy]-4-oxidanylidene-butanoate

Systemtic Name: sodium 4-[4-[5,7-bis(oxidanyl)-4-oxidanylidene-2,3-dihydrochromen-2-yl]phenoxy]-4-oxidanylidene-butanoate Openeye Name: sodium 4-[4-(5,7-dihydroxy-4-oxo-chroman-2-yl)phenoxy]-4-oxo-butanoate CAS Name: sodium 4-[4-(5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)phenoxy]-4-oxobutanoate IUPAC Name: sodium 4-[4-(5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl)phenoxy]-4-oxobutanoate Traditional Name: sodium 4-[4-(5,7-dihydroxy-4-keto-chroman-2-yl)phenoxy]-4-keto-butyrate Formula: C19H15NaO8 MolecularWeight: 394.30737

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)OC(=O)CCC(=O)[O-].[Na+]

Isomeric SMILES

C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)OC(=O)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C19H16O8.Na/c20-11-7-13(21)19-14(22)9-15(27-16(19)8-11)10-1-3-12(4-2-10)26-18(25)6-5-17(23)24;/h1-4,7-8,15,20-21H,5-6,9H2,(H,23,24);/q;+1/p-1