1,9-ditert-butyl-3,7-dimethyl-11-oxidanyl-benzo[d][1,3,6,2]benzodioxathiaphosphocine

Systemtic Name: 1,9-ditert-butyl-3,7-dimethyl-11-oxidanyl-benzo[d][1,3,6,2]benzodioxathiaphosphocine Openeye Name: 1,9-ditert-butyl-11-hydroxy-3,7-dimethyl-benzo[d][1,3,6,2]benzodioxathiaphosphocine CAS Name: 1,9-ditert-butyl-11-hydroxy-3,7-dimethylbenzo[d][1,3,6,2]benzodioxathiaphosphocin IUPAC Name: 1,9-ditert-butyl-11-hydroxy-3,7-dimethylbenzo[d][1,3,6,2]benzodioxathiaphosphocine Traditional Name: 1,9-ditert-butyl-11-hydroxy-3,7-dimethyl-benzo[d][1,3,6,2]benzodioxathiaphosphocin Formula: C22H29O3PS MolecularWeight: 404.502621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC3=CC(=CC(=C3OP(O2)O)C(C)(C)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC3=CC(=CC(=C3OP(O2)O)C(C)(C)C)C)C(C)(C)C

InChI

InChI=1S/C22H29O3PS/c1-13-9-15(21(3,4)5)19-17(11-13)27-18-12-14(2)10-16(22(6,7)8)20(18)25-26(23)24-19/h9-12,23H,1-8H3