sodium 5,7-bis(oxidanyl)-4-oxidanylidene-3-phenyl-chromene-2-carboxylate

Systemtic Name: sodium 5,7-bis(oxidanyl)-4-oxidanylidene-3-phenyl-chromene-2-carboxylate Openeye Name: sodium 5,7-dihydroxy-4-oxo-3-phenyl-chromene-2-carboxylate CAS Name: sodium 5,7-dihydroxy-4-oxo-3-phenyl-1-benzopyran-2-carboxylate IUPAC Name: sodium 5,7-dihydroxy-4-oxo-3-phenylchromene-2-carboxylate Traditional Name: sodium 5,7-dihydroxy-4-keto-3-phenyl-chromene-2-carboxylate Formula: C16H9NaO6 MolecularWeight: 320.22883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=CC(=CC(=C3C2=O)O)O)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=CC(=CC(=C3C2=O)O)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C16H10O6.Na/c17-9-6-10(18)13-11(7-9)22-15(16(20)21)12(14(13)19)8-4-2-1-3-5-8;/h1-7,17-18H,(H,20,21);/q;+1/p-1