2,4-bis(2,4-ditert-butylphenyl)benzene-1,3-diol diphosphate

Systemtic Name: 2,4-bis(2,4-ditert-butylphenyl)benzene-1,3-diol diphosphate Openeye Name: 2,4-bis(2,4-ditert-butylphenyl)benzene-1,3-diol diphosphate CAS Name: 2,4-bis(2,4-ditert-butylphenyl)benzene-1,3-diol diphosphate IUPAC Name: 2,4-bis(2,4-ditert-butylphenyl)benzene-1,3-diol diphosphate Traditional Name: 2,4-bis(2,4-ditert-butylphenyl)resorcinol diphosphate Formula: C34H46O10P2-6 MolecularWeight: 676.670562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)C2=C(C(=C(C=C2)O)C3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)C2=C(C(=C(C=C2)O)C3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C34H46O2.2H3O4P/c1-31(2,3)21-13-15-23(26(19-21)33(7,8)9)24-17-18-28(35)29(30(24)36)25-16-14-22(32(4,5)6)20-27(25)34(10,11)12;2*1-5(2,3)4/h13-20,35-36H,1-12H3;2*(H3,1,2,3,4)/p-6