2-[[4-(hexadecanoylamino)-2-(8-methoxyhexadecanoyl)phenoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[4-(hexadecanoylamino)-2-(8-methoxyhexadecanoyl)phenoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[4-(hexadecanoylamino)-2-(8-methoxyhexadecanoyl)phenoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-(8-methoxy-1-oxohexadecyl)-4-(1-oxohexadecylamino)phenoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[4-(hexadecanoylamino)-2-(8-methoxyhexadecanoyl)phenoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[2-(8-methoxyhexadecanoyl)-4-palmitamido-phenoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C44H82N2O7P+ MolecularWeight: 782.104841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)OP(=O)(O)OCC[N+](C)(C)C)C(=O)CCCCCCC(CCCCCCCC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)OP(=O)(O)OCC[N+](C)(C)C)C(=O)CCCCCCC(CCCCCCCC)OC

InChI

InChI=1S/C44H81N2O7P/c1-7-9-11-13-15-16-17-18-19-20-21-23-29-33-44(48)45-39-34-35-43(53-54(49,50)52-37-36-46(3,4)5)41(38-39)42(47)32-28-25-24-27-31-40(51-6)30-26-22-14-12-10-8-2/h34-35,38,40H,7-33,36-37H2,1-6H3,(H-,45,48,49,50)/p+1