[3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy-sulfanyl-phosphinothioyl]oxy-2-(6-oxidanylhexanoyloxy)propyl] 6-oxidanylhexanoate

Systemtic Name: [3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy-sulfanyl-phosphinothioyl]oxy-2-(6-oxidanylhexanoyloxy)propyl] 6-oxidanylhexanoate Openeye Name: [3-[2-(tert-butoxycarbonylamino)ethoxy-sulfanyl-phosphinothioyl]oxy-2-(6-hydroxyhexanoyloxy)propyl] 6-hydroxyhexanoate CAS Name: 6-hydroxyhexanoic acid [2-(6-hydroxy-1-oxohexoxy)-3-[mercapto-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethoxy]phosphinothioyl]oxypropyl] ester IUPAC Name: [2-(6-hydroxyhexanoyloxy)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy-sulfanylphosphinothioyl]oxypropyl] 6-hydroxyhexanoate Traditional Name: 6-hydroxyhexanoic acid [3-[2-(tert-butoxycarbonylamino)ethoxy-mercapto-thiophosphoryl]oxy-2-(6-hydroxyhexanoyloxy)propyl] ester Formula: C22H42NO10PS2 MolecularWeight: 575.673341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCOP(=S)(OCC(COC(=O)CCCCCO)OC(=O)CCCCCO)S

Isomeric SMILES

CC(C)(C)OC(=O)NCCOP(=S)(OCC(COC(=O)CCCCCO)OC(=O)CCCCCO)S

InChI

InChI=1S/C22H42NO10PS2/c1-22(2,3)33-21(28)23-12-15-30-34(35,36)31-17-18(32-20(27)11-7-5-9-14-25)16-29-19(26)10-6-4-8-13-24/h18,24-25H,4-17H2,1-3H3,(H,23,28)(H,35,36)