trimethyl-[2-[oxidanyl-(1-oxidanyl-4-oxidanylidene-2-tetradecanoyloxy-heptadecan-3-yl)oxy-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[oxidanyl-(1-oxidanyl-4-oxidanylidene-2-tetradecanoyloxy-heptadecan-3-yl)oxy-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[1-(2-hydroxy-1-tetradecanoyloxy-ethyl)-2-oxo-pentadecoxy]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[1-hydroxy-4-oxo-2-(1-oxotetradecoxy)heptadecan-3-yl]oxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-(1-hydroxy-4-oxo-2-tetradecanoyloxyheptadecan-3-yl)oxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[1-(2-hydroxy-1-tetradecanoyloxy-ethyl)-2-keto-pentadecoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C36H73NO8P+ MolecularWeight: 678.940481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)C(C(CO)OC(=O)CCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCC(=O)C(C(CO)OC(=O)CCCCCCCCCCCCC)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C36H72NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-33(39)36(45-46(41,42)43-31-30-37(3,4)5)34(32-38)44-35(40)29-27-25-23-21-19-17-15-13-11-9-7-2/h34,36,38H,6-32H2,1-5H3/p+1