sodium 2-methoxy-5-[5-oxidanyl-3-oxidanylidene-2-(3,4,5-trimethoxyphenyl)cyclopenten-1-yl]benzoate

Systemtic Name: sodium 2-methoxy-5-[5-oxidanyl-3-oxidanylidene-2-(3,4,5-trimethoxyphenyl)cyclopenten-1-yl]benzoate Openeye Name: sodium 5-[5-hydroxy-3-oxo-2-(3,4,5-trimethoxyphenyl)cyclopenten-1-yl]-2-methoxy-benzoate CAS Name: sodium 5-[5-hydroxy-3-oxo-2-(3,4,5-trimethoxyphenyl)-1-cyclopentenyl]-2-methoxybenzoate IUPAC Name: sodium 5-[5-hydroxy-3-oxo-2-(3,4,5-trimethoxyphenyl)cyclopenten-1-yl]-2-methoxybenzoate Traditional Name: sodium 5-[5-hydroxy-3-keto-2-(3,4,5-trimethoxyphenyl)cyclopenten-1-yl]-2-methoxy-benzoate Formula: C22H21NaO8 MolecularWeight: 436.38711

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)CC2O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)[O-].[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)CC2O)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)[O-].[Na+]

InChI

InChI=1S/C22H22O8.Na/c1-27-16-6-5-11(7-13(16)22(25)26)19-14(23)10-15(24)20(19)12-8-17(28-2)21(30-4)18(9-12)29-3;/h5-9,14,23H,10H2,1-4H3,(H,25,26);/q;+1/p-1