trimethyl-[5-[(3-octadecoxy-2-phenylmethoxy-propoxy)-oxidanyl-phosphoryl]oxypentyl]azanium

Systemtic Name: trimethyl-[5-[(3-octadecoxy-2-phenylmethoxy-propoxy)-oxidanyl-phosphoryl]oxypentyl]azanium Openeye Name: 5-[(2-benzyloxy-3-octadecoxy-propoxy)-hydroxy-phosphoryl]oxypentyl-trimethyl-ammonium CAS Name: 5-[hydroxy-(3-octadecoxy-2-phenylmethoxypropoxy)phosphoryl]oxypentyl-trimethylammonium IUPAC Name: 5-[hydroxy-(3-octadecoxy-2-phenylmethoxypropoxy)phosphoryl]oxypentyl-trimethylazanium Traditional Name: 5-[(2-benzoxy-3-stearyloxy-propoxy)-hydroxy-phosphoryl]oxypentyl-trimethyl-ammonium Formula: C36H69NO6P+ MolecularWeight: 642.909921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCCCCC[N+](C)(C)C)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCCCCC[N+](C)(C)C)OCC1=CC=CC=C1

InChI

InChI=1S/C36H68NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-30-40-33-36(41-32-35-27-22-20-23-28-35)34-43-44(38,39)42-31-26-21-24-29-37(2,3)4/h20,22-23,27-28,36H,5-19,21,24-26,29-34H2,1-4H3/p+1