octyl 3-[2,2-bis[4-bis(oxidanyl)phosphanyloxyphenyl]propylsulfanyl]propanoate

Systemtic Name: octyl 3-[2,2-bis[4-bis(oxidanyl)phosphanyloxyphenyl]propylsulfanyl]propanoate Openeye Name: octyl 3-[2,2-bis(4-dihydroxyphosphanyloxyphenyl)propylsulfanyl]propanoate CAS Name: 3-[2,2-bis(4-dihydroxyphosphinooxyphenyl)propylthio]propanoic acid octyl ester IUPAC Name: octyl 3-[2,2-bis(4-dihydroxyphosphanyloxyphenyl)propylsulfanyl]propanoate Traditional Name: 3-[2,2-bis(4-dihydroxyphosphinooxyphenyl)propylthio]propionic acid octyl ester Formula: C26H38O8P2S MolecularWeight: 572.587642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCSCC(C)(C1=CC=C(C=C1)OP(O)O)C2=CC=C(C=C2)OP(O)O

Isomeric SMILES

CCCCCCCCOC(=O)CCSCC(C)(C1=CC=C(C=C1)OP(O)O)C2=CC=C(C=C2)OP(O)O

InChI

InChI=1S/C26H38O8P2S/c1-3-4-5-6-7-8-18-32-25(27)17-19-37-20-26(2,21-9-13-23(14-10-21)33-35(28)29)22-11-15-24(16-12-22)34-36(30)31/h9-16,28-31H,3-8,17-20H2,1-2H3