sodium 2-methoxy-3,4-bis(oxidanyl)-5-(3-oxidanylidene-3-phenyl-propanoyl)benzoate

Systemtic Name: sodium 2-methoxy-3,4-bis(oxidanyl)-5-(3-oxidanylidene-3-phenyl-propanoyl)benzoate Openeye Name: sodium 3,4-dihydroxy-2-methoxy-5-(3-oxo-3-phenyl-propanoyl)benzoate CAS Name: sodium 5-(1,3-dioxo-3-phenylpropyl)-3,4-dihydroxy-2-methoxybenzoate IUPAC Name: sodium 3,4-dihydroxy-2-methoxy-5-(3-oxo-3-phenylpropanoyl)benzoate Traditional Name: sodium 3,4-dihydroxy-5-(3-keto-3-phenyl-propanoyl)-2-methoxy-benzoate Formula: C17H13NaO7 MolecularWeight: 352.27069

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1O)O)C(=O)CC(=O)C2=CC=CC=C2)C(=O)[O-].[Na+]

Isomeric SMILES

COC1=C(C=C(C(=C1O)O)C(=O)CC(=O)C2=CC=CC=C2)C(=O)[O-].[Na+]

InChI

InChI=1S/C17H14O7.Na/c1-24-16-11(17(22)23)7-10(14(20)15(16)21)13(19)8-12(18)9-5-3-2-4-6-9;/h2-7,20-21H,8H2,1H3,(H,22,23);/q;+1/p-1