2,3-bis(12-phenylmethoxydodecanoyloxy)propyl-trimethyl-azanium

Systemtic Name: 2,3-bis(12-phenylmethoxydodecanoyloxy)propyl-trimethyl-azanium Openeye Name: 2,3-bis(12-benzyloxydodecanoyloxy)propyl-trimethyl-ammonium CAS Name: 2,3-bis(1-oxo-12-phenylmethoxydodecoxy)propyl-trimethylammonium IUPAC Name: 2,3-bis(12-phenylmethoxydodecanoyloxy)propyl-trimethylazanium Traditional Name: 2,3-bis(12-benzoxydodecanoyloxy)propyl-trimethyl-ammonium Formula: C44H72NO6+ MolecularWeight: 711.04558

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(COC(=O)CCCCCCCCCCCOCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCOCC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(C)CC(COC(=O)CCCCCCCCCCCOCC1=CC=CC=C1)OC(=O)CCCCCCCCCCCOCC2=CC=CC=C2

InChI

InChI=1S/C44H72NO6/c1-45(2,3)36-42(51-44(47)33-25-15-11-7-5-9-13-17-27-35-49-38-41-30-22-19-23-31-41)39-50-43(46)32-24-14-10-6-4-8-12-16-26-34-48-37-40-28-20-18-21-29-40/h18-23,28-31,42H,4-17,24-27,32-39H2,1-3H3/q+1