[1-(2-bromanyloctadecanoyloxy)-3-oxidanyl-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [1-(2-bromanyloctadecanoyloxy)-3-oxidanyl-propan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [1-(2-bromooctadecanoyloxymethyl)-2-hydroxy-ethyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [1-(2-bromo-1-oxooctadecoxy)-3-hydroxypropan-2-yl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [1-(2-bromooctadecanoyloxy)-3-hydroxypropan-2-yl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [1-(2-bromooctadecanoyloxymethyl)-2-hydroxy-ethyl] 2-(trimethylammonio)ethyl phosphate Formula: C26H53BrNO7P MolecularWeight: 602.579281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)OCC(CO)OP(=O)([O-])OCC[N+](C)(C)C)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)OCC(CO)OP(=O)([O-])OCC[N+](C)(C)C)Br

InChI

InChI=1S/C26H53BrNO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(27)26(30)33-23-24(22-29)35-36(31,32)34-21-20-28(2,3)4/h24-25,29H,5-23H2,1-4H3