[2,3-bis(oxidanyl)propoxy-oxidanidyl-phosphoryl] phosphate; 2-hydroxyethyl(trimethyl)azanium

Systemtic Name: [2,3-bis(oxidanyl)propoxy-oxidanidyl-phosphoryl] phosphate; 2-hydroxyethyl(trimethyl)azanium Openeye Name: [2,3-dihydroxypropoxy(oxido)phosphoryl] phosphate; 2-hydroxyethyl(trimethyl)ammonium CAS Name: [2,3-dihydroxypropoxy(oxido)phosphoryl] phosphate; 2-hydroxyethyl(trimethyl)ammonium IUPAC Name: [2,3-dihydroxypropoxy(oxido)phosphoryl] phosphate; 2-hydroxyethyl(trimethyl)azanium Traditional Name: [glyceryloxy(oxido)phosphoryl] phosphate; 2-hydroxyethyl(trimethyl)ammonium Formula: C18H49N3O12P2 MolecularWeight: 561.542082

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.C(C(COP(=O)([O-])OP(=O)([O-])[O-])O)O

Isomeric SMILES

C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.C(C(COP(=O)([O-])OP(=O)([O-])[O-])O)O

InChI

InChI=1S/3C5H14NO.C3H10O9P2/c3*1-6(2,3)4-5-7;4-1-3(5)2-11-14(9,10)12-13(6,7)8/h3*7H,4-5H2,1-3H3;3-5H,1-2H2,(H,9,10)(H2,6,7,8)/q3*+1;/p-3