sodium (3,5-dimethylphenyl) [3-[3-(2-hydroxyphenyl)-3-oxidanylidene-propyl]phenyl] phosphate

Systemtic Name: sodium (3,5-dimethylphenyl) [3-[3-(2-hydroxyphenyl)-3-oxidanylidene-propyl]phenyl] phosphate Openeye Name: sodium (3,5-dimethylphenyl) [3-[3-(2-hydroxyphenyl)-3-oxo-propyl]phenyl] phosphate CAS Name: sodium (3,5-dimethylphenyl) [3-[3-(2-hydroxyphenyl)-3-oxopropyl]phenyl] phosphate IUPAC Name: sodium (3,5-dimethylphenyl) [3-[3-(2-hydroxyphenyl)-3-oxopropyl]phenyl] phosphate Traditional Name: sodium (3,5-dimethylphenyl) [3-[3-(2-hydroxyphenyl)-3-keto-propyl]phenyl] phosphate Formula: C23H22NaO6P MolecularWeight: 448.380711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OP(=O)([O-])OC2=CC=CC(=C2)CCC(=O)C3=CC=CC=C3O)C.[Na+]

Isomeric SMILES

CC1=CC(=CC(=C1)OP(=O)([O-])OC2=CC=CC(=C2)CCC(=O)C3=CC=CC=C3O)C.[Na+]

InChI

InChI=1S/C23H23O6P.Na/c1-16-12-17(2)14-20(13-16)29-30(26,27)28-19-7-5-6-18(15-19)10-11-23(25)21-8-3-4-9-22(21)24;/h3-9,12-15,24H,10-11H2,1-2H3,(H,26,27);/q;+1/p-1