diethyl phosphate; dodecyl-dimethyl-(2-oxidanyl-3-phenoxy-propyl)azanium

Systemtic Name: diethyl phosphate; dodecyl-dimethyl-(2-oxidanyl-3-phenoxy-propyl)azanium Openeye Name: diethyl phosphate; dodecyl-(2-hydroxy-3-phenoxy-propyl)-dimethyl-ammonium CAS Name: diethyl phosphate; dodecyl-(2-hydroxy-3-phenoxypropyl)-dimethylammonium IUPAC Name: diethyl phosphate; dodecyl-(2-hydroxy-3-phenoxypropyl)-dimethylazanium Traditional Name: diethyl phosphate; (2-hydroxy-3-phenoxy-propyl)-lauryl-dimethyl-ammonium Formula: C27H52NO6P MolecularWeight: 517.678641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CC(COC1=CC=CC=C1)O.CCOP(=O)([O-])OCC

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CC(COC1=CC=CC=C1)O.CCOP(=O)([O-])OCC

InChI

InChI=1S/C23H42NO2.C4H11O4P/c1-4-5-6-7-8-9-10-11-12-16-19-24(2,3)20-22(25)21-26-23-17-14-13-15-18-23;1-3-7-9(5,6)8-4-2/h13-15,17-18,22,25H,4-12,16,19-21H2,1-3H3;3-4H2,1-2H3,(H,5,6)/q+1;/p-1