2-[[3-[bis(4-methoxyphenyl)-phenyl-methoxy]-2-hexadecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[3-[bis(4-methoxyphenyl)-phenyl-methoxy]-2-hexadecanoyloxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[3-[bis(4-methoxyphenyl)-phenyl-methoxy]-2-hexadecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[3-[bis(4-methoxyphenyl)-phenylmethoxy]-2-(1-oxohexadecoxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[3-[bis(4-methoxyphenyl)-phenylmethoxy]-2-hexadecanoyloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[3-[bis(4-methoxyphenyl)-phenyl-methoxy]-2-hexadecanoyloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C45H69NO9P+ MolecularWeight: 799.004421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(COC(C1=CC=CC=C1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(COC(C1=CC=CC=C1)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C45H68NO9P/c1-7-8-9-10-11-12-13-14-15-16-17-18-22-25-44(47)55-43(37-54-56(48,49)53-35-34-46(2,3)4)36-52-45(38-23-20-19-21-24-38,39-26-30-41(50-5)31-27-39)40-28-32-42(51-6)33-29-40/h19-21,23-24,26-33,43H,7-18,22,25,34-37H2,1-6H3/p+1