sodium (2,6-ditert-butylphenyl) [4-(phenylcarbonyl)phenyl] phosphate

Systemtic Name: sodium (2,6-ditert-butylphenyl) [4-(phenylcarbonyl)phenyl] phosphate Openeye Name: sodium (4-benzoylphenyl) (2,6-ditert-butylphenyl) phosphate CAS Name: sodium (4-benzoylphenyl) (2,6-ditert-butylphenyl) phosphate IUPAC Name: sodium (4-benzoylphenyl) (2,6-ditert-butylphenyl) phosphate Traditional Name: sodium (4-benzoylphenyl) (2,6-ditert-butylphenyl) phosphate Formula: C27H30NaO5P MolecularWeight: 488.487631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31O5P.Na/c1-26(2,3)22-13-10-14-23(27(4,5)6)25(22)32-33(29,30)31-21-17-15-20(16-18-21)24(28)19-11-8-7-9-12-19;/h7-18H,1-6H3,(H,29,30);/q;+1/p-1