2-[[14-(ethyldisulfanyl)-1,2-bis(oxidanyl)-4-oxidanylidene-tetradecan-3-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[14-(ethyldisulfanyl)-1,2-bis(oxidanyl)-4-oxidanylidene-tetradecan-3-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[1-(1,2-dihydroxyethyl)-12-(ethyldisulfanyl)-2-oxo-dodecoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[14-(ethyldisulfanyl)-1,2-dihydroxy-4-oxotetradecan-3-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[14-(ethyldisulfanyl)-1,2-dihydroxy-4-oxotetradecan-3-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(1,2-dihydroxyethyl)-12-(ethyldisulfanyl)-2-keto-dodecoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C21H45NO7PS2+ MolecularWeight: 518.688261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSSCCCCCCCCCCC(=O)C(C(CO)O)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCSSCCCCCCCCCCC(=O)C(C(CO)O)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C21H44NO7PS2/c1-5-31-32-17-13-11-9-7-6-8-10-12-14-19(24)21(20(25)18-23)29-30(26,27)28-16-15-22(2,3)4/h20-21,23,25H,5-18H2,1-4H3/p+1