trimethyl-[2-[[2-(octadecoxymethyl)-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]ethyl]azanium

Systemtic Name: trimethyl-[2-[[2-(octadecoxymethyl)-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]ethyl]azanium Openeye Name: 2-[hydroxy-[2-(octadecoxymethyl)-4-oxo-pentoxy]phosphoryl]ethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-(octadecoxymethyl)-4-oxopentoxy]phosphoryl]ethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[2-(octadecoxymethyl)-4-oxopentoxy]phosphoryl]ethyl-trimethylazanium Traditional Name: 2-[hydroxy-[4-keto-2-(stearyloxymethyl)pentoxy]phosphoryl]ethyl-trimethyl-ammonium Formula: C29H61NO5P+ MolecularWeight: 534.772101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(=O)(CC[N+](C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(=O)(CC[N+](C)(C)C)O

InChI

InChI=1S/C29H60NO5P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-34-26-29(25-28(2)31)27-35-36(32,33)24-22-30(3,4)5/h29H,6-27H2,1-5H3/p+1