sodium [4-(3,5-dimethyl-4-oxidanyl-phenyl)phenyl] (2,6-dimethylphenyl) phosphate

Systemtic Name: sodium [4-(3,5-dimethyl-4-oxidanyl-phenyl)phenyl] (2,6-dimethylphenyl) phosphate Openeye Name: sodium (2,6-dimethylphenyl) [4-(4-hydroxy-3,5-dimethyl-phenyl)phenyl] phosphate CAS Name: sodium (2,6-dimethylphenyl) [4-(4-hydroxy-3,5-dimethylphenyl)phenyl] phosphate IUPAC Name: sodium (2,6-dimethylphenyl) [4-(4-hydroxy-3,5-dimethylphenyl)phenyl] phosphate Traditional Name: sodium (2,6-dimethylphenyl) [4-(4-hydroxy-3,5-dimethyl-phenyl)phenyl] phosphate Formula: C22H22NaO5P MolecularWeight: 420.370611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23O5P.Na/c1-14-6-5-7-15(2)22(14)27-28(24,25)26-20-10-8-18(9-11-20)19-12-16(3)21(23)17(4)13-19;/h5-13,23H,1-4H3,(H,24,25);/q;+1/p-1