sodium 3-[3-(4-methoxy-3-oxidanyl-phenyl)-3-oxidanylidene-propanoyl]-4-oxidanyl-benzoate

Systemtic Name: sodium 3-[3-(4-methoxy-3-oxidanyl-phenyl)-3-oxidanylidene-propanoyl]-4-oxidanyl-benzoate Openeye Name: sodium 4-hydroxy-3-[3-(3-hydroxy-4-methoxy-phenyl)-3-oxo-propanoyl]benzoate CAS Name: sodium 4-hydroxy-3-[3-(3-hydroxy-4-methoxyphenyl)-1,3-dioxopropyl]benzoate IUPAC Name: sodium 4-hydroxy-3-[3-(3-hydroxy-4-methoxyphenyl)-3-oxopropanoyl]benzoate Traditional Name: sodium 4-hydroxy-3-[3-(3-hydroxy-4-methoxy-phenyl)-3-keto-propanoyl]benzoate Formula: C17H13NaO7 MolecularWeight: 352.27069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CC(=O)C2=C(C=CC(=C2)C(=O)[O-])O)O.[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CC(=O)C2=C(C=CC(=C2)C(=O)[O-])O)O.[Na+]

InChI

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