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

Systemtic Name: 1,3,7,9-tetratert-butyl-11-methylsulfanyl-11-sulfanylidene-5H-benzo[d][1,3,2]benzodioxaphosphocine Openeye Name: 1,3,7,9-tetratert-butyl-11-methylsulfanyl-11-thioxo-5H-benzo[d][1,3,2]benzodioxaphosphocine CAS Name: 1,3,7,9-tetratert-butyl-11-(methylthio)-11-sulfanylidene-5H-benzo[d][1,3,2]benzodioxaphosphocin IUPAC Name: 1,3,7,9-tetratert-butyl-11-methylsulfanyl-11-sulfanylidene-5H-benzo[d][1,3,2]benzodioxaphosphocine Traditional Name: 1,3,7,9-tetratert-butyl-11-(methylthio)-11-thioxo-5H-benzo[d][1,3,2]benzodioxaphosphocin Formula: C30H45O2PS2 MolecularWeight: 532.780861

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)CC3=CC(=CC(=C3OP(=S)(O2)SC)C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)CC3=CC(=CC(=C3OP(=S)(O2)SC)C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C30H45O2PS2/c1-27(2,3)21-15-19-14-20-16-22(28(4,5)6)18-24(30(10,11)12)26(20)32-33(34,35-13)31-25(19)23(17-21)29(7,8)9/h15-18H,14H2,1-13H3