sodium (3,5-dimethoxyphenyl) [4-(4-methoxyphenyl)carbonylphenyl] phosphate

Systemtic Name: sodium (3,5-dimethoxyphenyl) [4-(4-methoxyphenyl)carbonylphenyl] phosphate Openeye Name: sodium (3,5-dimethoxyphenyl) [4-(4-methoxybenzoyl)phenyl] phosphate CAS Name: sodium (3,5-dimethoxyphenyl) [4-[(4-methoxyphenyl)-oxomethyl]phenyl] phosphate IUPAC Name: sodium (3,5-dimethoxyphenyl) [4-(4-methoxybenzoyl)phenyl] phosphate Traditional Name: sodium (3,5-dimethoxyphenyl) (4-p-anisoylphenyl) phosphate Formula: C22H20NaO8P MolecularWeight: 466.352931

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OP(=O)([O-])OC3=CC(=CC(=C3)OC)OC.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OP(=O)([O-])OC3=CC(=CC(=C3)OC)OC.[Na+]

InChI

InChI=1S/C22H21O8P.Na/c1-26-17-8-4-15(5-9-17)22(23)16-6-10-18(11-7-16)29-31(24,25)30-21-13-19(27-2)12-20(14-21)28-3;/h4-14H,1-3H3,(H,24,25);/q;+1/p-1