2-[[3-(butanoylamino)-2-nonadecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[3-(butanoylamino)-2-nonadecoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[3-(butanoylamino)-2-nonadecoxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[2-nonadecoxy-3-(1-oxobutylamino)propoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[3-(butanoylamino)-2-nonadecoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[(3-butyramido-2-nonadecoxy-propoxy)-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C31H66N2O6P+ MolecularWeight: 593.839301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCOC(CNC(=O)CCC)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCOC(CNC(=O)CCC)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C31H65N2O6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-37-30(28-32-31(34)24-7-2)29-39-40(35,36)38-27-25-33(3,4)5/h30H,6-29H2,1-5H3,(H-,32,34,35,36)/p+1