sodium (3-hydroxyphenyl) [4-[3-(4-hydroxyphenyl)propanoyl]phenyl] oxidanyl phosphate

Systemtic Name: sodium (3-hydroxyphenyl) [4-[3-(4-hydroxyphenyl)propanoyl]phenyl] oxidanyl phosphate Openeye Name: sodium hydroxy (3-hydroxyphenyl) [4-[3-(4-hydroxyphenyl)propanoyl]phenyl] phosphate CAS Name: sodium phosphoric acid hydroxy (3-hydroxyphenyl) [4-[3-(4-hydroxyphenyl)-1-oxopropyl]phenyl] ester IUPAC Name: sodium hydroxy (3-hydroxyphenyl) [4-[3-(4-hydroxyphenyl)propanoyl]phenyl] phosphate Traditional Name: sodium phosphoric acid hydroxy (3-hydroxyphenyl) [4-[3-(4-hydroxyphenyl)propanoyl]phenyl] ester Formula: C21H19NaO8P+ MolecularWeight: 453.334291

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OP(=O)(OC2=CC=C(C=C2)C(=O)CCC3=CC=C(C=C3)O)OO)O.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)OP(=O)(OC2=CC=C(C=C2)C(=O)CCC3=CC=C(C=C3)O)OO)O.[Na+]

InChI

InChI=1S/C21H19O8P.Na/c22-17-9-4-15(5-10-17)6-13-21(24)16-7-11-19(12-8-16)27-30(26,29-25)28-20-3-1-2-18(23)14-20;/h1-5,7-12,14,22-23,25H,6,13H2;/q;+1