[12-bis(oxidanyl)phosphanyloxy-11,11-bis(hydroxymethyl)-10-phenyl-henicosan-10-yl] dihydrogen phosphite

Systemtic Name: [12-bis(oxidanyl)phosphanyloxy-11,11-bis(hydroxymethyl)-10-phenyl-henicosan-10-yl] dihydrogen phosphite Openeye Name: [3-dihydroxyphosphanyloxy-2,2-bis(hydroxymethyl)-1-nonyl-1-phenyl-dodecyl] dihydrogen phosphite CAS Name: [12-dihydroxyphosphinooxy-11,11-bis(hydroxymethyl)-10-phenylheneicosan-10-yl] dihydrogen phosphite IUPAC Name: [12-dihydroxyphosphanyloxy-11,11-bis(hydroxymethyl)-10-phenylhenicosan-10-yl] dihydrogen phosphite Traditional Name: (3-dihydroxyphosphinooxy-2,2-dimethylol-1-nonyl-1-phenyl-dodecyl) dihydrogen phosphite Formula: C29H54O8P2 MolecularWeight: 592.681782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(CO)(CO)C(CCCCCCCCC)(C1=CC=CC=C1)OP(O)O)OP(O)O

Isomeric SMILES

CCCCCCCCCC(C(CO)(CO)C(CCCCCCCCC)(C1=CC=CC=C1)OP(O)O)OP(O)O

InChI

InChI=1S/C29H54O8P2/c1-3-5-7-9-11-13-18-22-27(36-38(32)33)28(24-30,25-31)29(37-39(34)35,26-20-16-15-17-21-26)23-19-14-12-10-8-6-4-2/h15-17,20-21,27,30-35H,3-14,18-19,22-25H2,1-2H3