[2-(2-butylhexanoyloxy)-3-(triphenylmethyl)oxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [2-(2-butylhexanoyloxy)-3-(triphenylmethyl)oxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [2-(2-butylhexanoyloxy)-3-trityloxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [2-(2-butyl-1-oxohexoxy)-3-(triphenylmethyl)oxypropyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [2-(2-butylhexanoyloxy)-3-trityloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [2-(2-butylhexanoyloxy)-3-trityloxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C37H52NO7P MolecularWeight: 653.785041

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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