tetrasodium [2-phosphonatooxy-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] phosphate

Systemtic Name: tetrasodium [2-phosphonatooxy-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] phosphate Openeye Name: tetrasodium [2-phosphonatooxy-4-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl] phosphate CAS Name: tetrasodium [2-phosphonatooxy-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] phosphate IUPAC Name: tetrasodium [2-phosphonatooxy-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] phosphate Traditional Name: tetrasodium [2-phosphato-4-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl] phosphate Formula: C17H16Na4O11P2 MolecularWeight: 550.208942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC2=CC(=C(C=C2)OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C\C2=CC(=C(C=C2)OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C17H20O11P2.4Na/c1-24-15-9-12(10-16(25-2)17(15)26-3)5-4-11-6-7-13(27-29(18,19)20)14(8-11)28-30(21,22)23;;;;/h4-10H,1-3H3,(H2,18,19,20)(H2,21,22,23);;;;/q;4*+1/p-4/b5-4-;;;;