2-[[3-(heptadecylcarbamoyloxy)-2-(1,2-oxazol-3-yloxy)propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[3-(heptadecylcarbamoyloxy)-2-(1,2-oxazol-3-yloxy)propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[3-(heptadecylcarbamoyloxy)-2-isoxazol-3-yloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[3-[(heptadecylamino)-oxomethoxy]-2-(3-isoxazolyloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[3-(heptadecylcarbamoyloxy)-2-(1,2-oxazol-3-yloxy)propoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[3-(heptadecylcarbamoyloxy)-2-isoxazol-3-yloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C29H57N3O8P+ MolecularWeight: 606.751941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCNC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC1=NOC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCNC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC1=NOC=C1

InChI

InChI=1S/C29H56N3O8P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-30-29(33)36-25-27(40-28-20-23-37-31-28)26-39-41(34,35)38-24-22-32(2,3)4/h20,23,27H,5-19,21-22,24-26H2,1-4H3,(H-,30,33,34,35)/p+1