2-[[2-(2-butylhexanoyloxy)-3-(triphenylmethyl)oxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[2-(2-butylhexanoyloxy)-3-(triphenylmethyl)oxy-propoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-(2-butylhexanoyloxy)-3-trityloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-(2-butyl-1-oxohexoxy)-3-(triphenylmethyl)oxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-(2-butylhexanoyloxy)-3-trityloxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[2-(2-butylhexanoyloxy)-3-trityloxy-propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C37H53NO7P+ MolecularWeight: 654.792981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)C(=O)OC(COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)COP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCC(CCCC)C(=O)OC(COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)COP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C37H52NO7P/c1-6-8-19-31(20-9-7-2)36(39)45-35(30-44-46(40,41)43-28-27-38(3,4)5)29-42-37(32-21-13-10-14-22-32,33-23-15-11-16-24-33)34-25-17-12-18-26-34/h10-18,21-26,31,35H,6-9,19-20,27-30H2,1-5H3/p+1