2-[(2-butanoyloxy-3-pentadecoxy-propoxy)-oxidanyl-phosphoryl]ethyl-methyl-azanium

Systemtic Name: 2-[(2-butanoyloxy-3-pentadecoxy-propoxy)-oxidanyl-phosphoryl]ethyl-methyl-azanium Openeye Name: 2-[(2-butanoyloxy-3-pentadecoxy-propoxy)-hydroxy-phosphoryl]ethyl-methyl-ammonium CAS Name: 2-[hydroxy-[2-(1-oxobutoxy)-3-pentadecoxypropoxy]phosphoryl]ethyl-methylammonium IUPAC Name: 2-[(2-butanoyloxy-3-pentadecoxypropoxy)-hydroxyphosphoryl]ethyl-methylazanium Traditional Name: 2-[(2-butyryloxy-3-pentadecoxy-propoxy)-hydroxy-phosphoryl]ethyl-methyl-ammonium Formula: C25H53NO6P+ MolecularWeight: 494.665181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOCC(COP(=O)(CC[NH2+]C)O)OC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCOCC(COP(=O)(CC[NH2+]C)O)OC(=O)CCC

InChI

InChI=1S/C25H52NO6P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-30-22-24(32-25(27)18-5-2)23-31-33(28,29)21-19-26-3/h24,26H,4-23H2,1-3H3,(H,28,29)/p+1