2-[[3-(12-hexyloctadecoxy)-2-methoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[3-(12-hexyloctadecoxy)-2-methoxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[3-(12-hexyloctadecoxy)-2-methoxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[3-(12-hexyloctadecoxy)-2-methoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[3-(12-hexyloctadecoxy)-2-methoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[3-(12-hexyloctadecoxy)-2-methoxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C33H71NO6P+ MolecularWeight: 608.893701

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCC)CCCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC

Isomeric SMILES

CCCCCCC(CCCCCC)CCCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC

InChI

InChI=1S/C33H70NO6P/c1-7-9-11-20-24-32(25-21-12-10-8-2)26-22-18-16-14-13-15-17-19-23-28-38-30-33(37-6)31-40-41(35,36)39-29-27-34(3,4)5/h32-33H,7-31H2,1-6H3/p+1