2-[[3-(dodecanoylamino)-2-heptadecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[3-(dodecanoylamino)-2-heptadecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[3-(dodecanoylamino)-2-heptadecoxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-heptadecoxy-3-(1-oxododecylamino)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[3-(dodecanoylamino)-2-heptadecoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[2-heptadecoxy-3-(lauroylamino)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C37H78N2O6P+ MolecularWeight: 677.998781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(CNC(=O)CCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(CNC(=O)CCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C37H77N2O6P/c1-6-8-10-12-14-16-17-18-19-20-21-23-25-27-29-32-43-36(35-45-46(41,42)44-33-31-39(3,4)5)34-38-37(40)30-28-26-24-22-15-13-11-9-7-2/h36H,6-35H2,1-5H3,(H-,38,40,41,42)/p+1