1,3,7,9-tetratert-butyl-11-tridecoxy-5H-benzo[d][1,3,2]benzodioxaphosphocine

Systemtic Name: 1,3,7,9-tetratert-butyl-11-tridecoxy-5H-benzo[d][1,3,2]benzodioxaphosphocine Openeye Name: 1,3,7,9-tetratert-butyl-11-tridecoxy-5H-benzo[d][1,3,2]benzodioxaphosphocine CAS Name: 1,3,7,9-tetratert-butyl-11-tridecoxy-5H-benzo[d][1,3,2]benzodioxaphosphocin IUPAC Name: 1,3,7,9-tetratert-butyl-11-tridecoxy-5H-benzo[d][1,3,2]benzodioxaphosphocine Traditional Name: 1,3,7,9-tetratert-butyl-11-tridecoxy-5H-benzo[d][1,3,2]benzodioxaphosphocin Formula: C42H69O3P MolecularWeight: 652.969221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOP1OC2=C(C=C(C=C2CC3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCOP1OC2=C(C=C(C=C2CC3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C42H69O3P/c1-14-15-16-17-18-19-20-21-22-23-24-25-43-46-44-37-31(27-33(39(2,3)4)29-35(37)41(8,9)10)26-32-28-34(40(5,6)7)30-36(38(32)45-46)42(11,12)13/h27-30H,14-26H2,1-13H3