2-[[2-[2-[(6-decanoylnaphthalen-2-yl)-methyl-amino]ethanoyloxy]-3-dodecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-[2-[(6-decanoylnaphthalen-2-yl)-methyl-amino]ethanoyloxy]-3-dodecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-[2-[(6-decanoyl-2-naphthyl)-methyl-amino]acetyl]oxy-3-dodecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-[2-[methyl-[6-(1-oxodecyl)-2-naphthalenyl]amino]-1-oxoethoxy]-3-(1-oxododecoxy)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-[2-[(6-decanoylnaphthalen-2-yl)-methylamino]acetyl]oxy-3-dodecanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[2-[2-[(6-capryl-2-naphthyl)-methyl-amino]acetyl]oxy-3-lauroyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C43H72N2O9P+ MolecularWeight: 792.013541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CN(C)C1=CC2=C(C=C1)C=C(C=C2)C(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CN(C)C1=CC2=C(C=C1)C=C(C=C2)C(=O)CCCCCCCCC

InChI

InChI=1S/C43H71N2O9P/c1-7-9-11-13-15-16-18-20-22-24-42(47)51-34-40(35-53-55(49,50)52-30-29-45(4,5)6)54-43(48)33-44(3)39-28-27-36-31-38(26-25-37(36)32-39)41(46)23-21-19-17-14-12-10-8-2/h25-28,31-32,40H,7-24,29-30,33-35H2,1-6H3/p+1