[2,3,5,6-tetrakis(2,4-dimethylphenyl)-4-phosphonooxy-phenyl] dihydrogen phosphate

Systemtic Name: [2,3,5,6-tetrakis(2,4-dimethylphenyl)-4-phosphonooxy-phenyl] dihydrogen phosphate Openeye Name: [2,3,5,6-tetrakis(2,4-dimethylphenyl)-4-phosphonooxy-phenyl] dihydrogen phosphate CAS Name: [2,3,5,6-tetrakis(2,4-dimethylphenyl)-4-phosphonooxyphenyl] dihydrogen phosphate IUPAC Name: [2,3,5,6-tetrakis(2,4-dimethylphenyl)-4-phosphonooxyphenyl] dihydrogen phosphate Traditional Name: [2,3,5,6-tetrakis(2,4-dimethylphenyl)-4-phosphonooxy-phenyl] dihydrogen phosphate Formula: C38H40O8P2 MolecularWeight: 686.666922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C(=C(C(=C2OP(=O)(O)O)C3=C(C=C(C=C3)C)C)C4=C(C=C(C=C4)C)C)OP(=O)(O)O)C5=C(C=C(C=C5)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C(=C(C(=C2OP(=O)(O)O)C3=C(C=C(C=C3)C)C)C4=C(C=C(C=C4)C)C)OP(=O)(O)O)C5=C(C=C(C=C5)C)C)C

InChI

InChI=1S/C38H40O8P2/c1-21-9-13-29(25(5)17-21)33-34(30-14-10-22(2)18-26(30)6)38(46-48(42,43)44)36(32-16-12-24(4)20-28(32)8)35(37(33)45-47(39,40)41)31-15-11-23(3)19-27(31)7/h9-20H,1-8H3,(H2,39,40,41)(H2,42,43,44)