2-[2,3-di(pentanoyloxy)propoxy-sulfanyl-phosphinothioyl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2,3-di(pentanoyloxy)propoxy-sulfanyl-phosphinothioyl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2,3-di(pentanoyloxy)propoxy-sulfanyl-phosphinothioyl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2,3-bis(1-oxopentoxy)propoxy-mercaptophosphinothioyl]oxyethyl-trimethylammonium IUPAC Name: 2-[2,3-di(pentanoyloxy)propoxy-sulfanylphosphinothioyl]oxyethyl-trimethylazanium Traditional Name: 2-[2,3-divaleryloxypropoxy(mercapto)thiophosphoryl]oxyethyl-trimethyl-ammonium Formula: C18H37NO6PS2+ MolecularWeight: 458.593241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC(COP(=S)(OCC[N+](C)(C)C)S)OC(=O)CCCC

Isomeric SMILES

CCCCC(=O)OCC(COP(=S)(OCC[N+](C)(C)C)S)OC(=O)CCCC

InChI

InChI=1S/C18H36NO6PS2/c1-6-8-10-17(20)22-14-16(25-18(21)11-9-7-2)15-24-26(27,28)23-13-12-19(3,4)5/h16H,6-15H2,1-5H3/p+1