sodium (3,5-dimethylphenyl) [4-(2-methoxy-2-phenyl-ethanoyl)phenyl] phosphate

Systemtic Name: sodium (3,5-dimethylphenyl) [4-(2-methoxy-2-phenyl-ethanoyl)phenyl] phosphate Openeye Name: sodium (3,5-dimethylphenyl) [4-(2-methoxy-2-phenyl-acetyl)phenyl] phosphate CAS Name: sodium (3,5-dimethylphenyl) [4-(2-methoxy-1-oxo-2-phenylethyl)phenyl] phosphate IUPAC Name: sodium (3,5-dimethylphenyl) [4-(2-methoxy-2-phenylacetyl)phenyl] phosphate Traditional Name: sodium (3,5-dimethylphenyl) [4-(2-methoxy-2-phenyl-acetyl)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=C(C=C2)C(=O)C(C3=CC=CC=C3)OC)C.[Na+]

Isomeric SMILES

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

InChI

InChI=1S/C23H23O6P.Na/c1-16-13-17(2)15-21(14-16)29-30(25,26)28-20-11-9-18(10-12-20)22(24)23(27-3)19-7-5-4-6-8-19;/h4-15,23H,1-3H3,(H,25,26);/q;+1/p-1