disodium 5-[5-(2-carboxylato-4-oxidanylidene-chromen-5-yl)-3-oxidanyl-pentyl]-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: disodium 5-[5-(2-carboxylato-4-oxidanylidene-chromen-5-yl)-3-oxidanyl-pentyl]-4-oxidanylidene-chromene-2-carboxylate Openeye Name: disodium 5-[5-(2-carboxylato-4-oxo-chromen-5-yl)-3-hydroxy-pentyl]-4-oxo-chromene-2-carboxylate CAS Name: disodium 5-[5-(2-carboxylato-4-oxo-1-benzopyran-5-yl)-3-hydroxypentyl]-4-oxo-1-benzopyran-2-carboxylate IUPAC Name: disodium 5-[5-(2-carboxylato-4-oxochromen-5-yl)-3-hydroxypentyl]-4-oxochromene-2-carboxylate Traditional Name: disodium 5-[5-(2-carboxylato-4-keto-chromen-5-yl)-3-hydroxy-pentyl]-4-keto-chromene-2-carboxylate Formula: C25H18Na2O9 MolecularWeight: 508.38456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC(=CC2=O)C(=O)[O-])CCC(CCC3=C4C(=CC=C3)OC(=CC4=O)C(=O)[O-])O.[Na+].[Na+]

Isomeric SMILES

C1=CC(=C2C(=C1)OC(=CC2=O)C(=O)[O-])CCC(CCC3=C4C(=CC=C3)OC(=CC4=O)C(=O)[O-])O.[Na+].[Na+]

InChI

InChI=1S/C25H20O9.2Na/c26-15(9-7-13-3-1-5-18-22(13)16(27)11-20(33-18)24(29)30)10-8-14-4-2-6-19-23(14)17(28)12-21(34-19)25(31)32;;/h1-6,11-12,15,26H,7-10H2,(H,29,30)(H,31,32);;/q;2*+1/p-2