2-[[(2R)-2,3-bis(11-oxidanylundecanoyloxy)propoxy]-sulfanyl-phosphinothioyl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2R)-2,3-bis(11-oxidanylundecanoyloxy)propoxy]-sulfanyl-phosphinothioyl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2R)-2,3-bis(11-hydroxyundecanoyloxy)propoxy]-sulfanyl-phosphinothioyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[(2R)-2,3-bis(11-hydroxy-1-oxoundecoxy)propoxy]-mercaptophosphinothioyl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2R)-2,3-bis(11-hydroxyundecanoyloxy)propoxy]-sulfanylphosphinothioyl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2R)-2,3-bis(11-hydroxyundecanoyloxy)propoxy]-mercapto-thiophosphoryl]oxyethyl-trimethyl-ammonium Formula: C30H61NO8PS2+ MolecularWeight: 658.911001

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOP(=S)(OCC(COC(=O)CCCCCCCCCCO)OC(=O)CCCCCCCCCCO)S

Isomeric SMILES

C[N+](C)(C)CCOP(=S)(OC[C@@H](COC(=O)CCCCCCCCCCO)OC(=O)CCCCCCCCCCO)S

InChI

InChI=1S/C30H60NO8PS2/c1-31(2,3)22-25-37-40(41,42)38-27-28(39-30(35)21-17-13-9-5-7-11-15-19-24-33)26-36-29(34)20-16-12-8-4-6-10-14-18-23-32/h28,32-33H,4-27H2,1-3H3/p+1/t28-/m1/s1