2-[[2-(hexadecanoylamino)-4-methyl-pentoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-(hexadecanoylamino)-4-methyl-pentoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-(hexadecanoylamino)-4-methyl-pentoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[4-methyl-2-(1-oxohexadecylamino)pentoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-(hexadecanoylamino)-4-methylpentoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-(4-methyl-2-palmitamido-pentoxy)phosphoryl]oxyethyl-trimethyl-ammonium Formula: C27H58N2O5P+ MolecularWeight: 521.733581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CC(C)C)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(CC(C)C)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C27H57N2O5P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(30)28-26(23-25(2)3)24-34-35(31,32)33-22-21-29(4,5)6/h25-26H,7-24H2,1-6H3,(H-,28,30,31,32)/p+1