trimethyl-[10-[[3-(15-methylhexadecoxy)-2-phenylmethoxy-propoxy]-oxidanyl-phosphoryl]oxydecyl]azanium

Systemtic Name: trimethyl-[10-[[3-(15-methylhexadecoxy)-2-phenylmethoxy-propoxy]-oxidanyl-phosphoryl]oxydecyl]azanium Openeye Name: 10-[[2-benzyloxy-3-(15-methylhexadecoxy)propoxy]-hydroxy-phosphoryl]oxydecyl-trimethyl-ammonium CAS Name: 10-[hydroxy-[3-(15-methylhexadecoxy)-2-phenylmethoxypropoxy]phosphoryl]oxydecyl-trimethylammonium IUPAC Name: 10-[hydroxy-[3-(15-methylhexadecoxy)-2-phenylmethoxypropoxy]phosphoryl]oxydecyl-trimethylazanium Traditional Name: 10-[[2-benzoxy-3-(15-methylhexadecoxy)propoxy]-hydroxy-phosphoryl]oxydecyl-trimethyl-ammonium Formula: C40H77NO6P+ MolecularWeight: 699.016241

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCOCC(COP(=O)(O)OCCCCCCCCCC[N+](C)(C)C)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCOCC(COP(=O)(O)OCCCCCCCCCC[N+](C)(C)C)OCC1=CC=CC=C1

InChI

InChI=1S/C40H76NO6P/c1-38(2)29-23-18-14-10-8-6-7-9-12-16-20-27-33-44-36-40(45-35-39-30-24-22-25-31-39)37-47-48(42,43)46-34-28-21-17-13-11-15-19-26-32-41(3,4)5/h22,24-25,30-31,38,40H,6-21,23,26-29,32-37H2,1-5H3/p+1