2-[(3-hexadecoxy-2-propanoyloxy-propoxy)-oxidanyl-phosphoryl]ethyl-methyl-azanium

Systemtic Name: 2-[(3-hexadecoxy-2-propanoyloxy-propoxy)-oxidanyl-phosphoryl]ethyl-methyl-azanium Openeye Name: 2-[(3-hexadecoxy-2-propanoyloxy-propoxy)-hydroxy-phosphoryl]ethyl-methyl-ammonium CAS Name: 2-[[3-hexadecoxy-2-(1-oxopropoxy)propoxy]-hydroxyphosphoryl]ethyl-methylammonium IUPAC Name: 2-[(3-hexadecoxy-2-propanoyloxypropoxy)-hydroxyphosphoryl]ethyl-methylazanium Traditional Name: 2-[(3-cetyloxy-2-propionyloxy-propoxy)-hydroxy-phosphoryl]ethyl-methyl-ammonium Formula: C25H53NO6P+ MolecularWeight: 494.665181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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