3,7-dioctyl-11-oxidanyl-benzo[d][1,3,6,2]benzodioxathiaphosphocine 11-oxide

Systemtic Name: 3,7-dioctyl-11-oxidanyl-benzo[d][1,3,6,2]benzodioxathiaphosphocine 11-oxide Openeye Name: 11-hydroxy-3,7-dioctyl-benzo[d][1,3,6,2]benzodioxathiaphosphocine 11-oxide CAS Name: 11-hydroxy-3,7-dioctylbenzo[d][1,3,6,2]benzodioxathiaphosphocin 11-oxide IUPAC Name: 11-hydroxy-3,7-dioctylbenzo[d][1,3,6,2]benzodioxathiaphosphocine 11-oxide Traditional Name: 11-hydroxy-3,7-dioctyl-benzo[d][1,3,6,2]benzodioxathiaphosphocin 11-oxide Formula: C28H41O4PS MolecularWeight: 504.661501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=C(C=C1)OP(=O)(OC3=C(S2)C=C(C=C3)CCCCCCCC)O

Isomeric SMILES

CCCCCCCCC1=CC2=C(C=C1)OP(=O)(OC3=C(S2)C=C(C=C3)CCCCCCCC)O

InChI

InChI=1S/C28H41O4PS/c1-3-5-7-9-11-13-15-23-17-19-25-27(21-23)34-28-22-24(16-14-12-10-8-6-4-2)18-20-26(28)32-33(29,30)31-25/h17-22H,3-16H2,1-2H3,(H,29,30)