2-[[(2S)-2-hexanoyloxy-3-oxidanyl-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(2S)-2-hexanoyloxy-3-oxidanyl-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[(2S)-2-hexanoyloxy-3-hydroxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[(2S)-3-hydroxy-2-(1-oxohexoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[(2S)-2-hexanoyloxy-3-hydroxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[(2S)-2-caproyloxy-3-hydroxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C14H31NO7P+ MolecularWeight: 356.372201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(CO)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCC(=O)O[C@@H](CO)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C14H30NO7P/c1-5-6-7-8-14(17)22-13(11-16)12-21-23(18,19)20-10-9-15(2,3)4/h13,16H,5-12H2,1-4H3/p+1/t13-/m0/s1