trimethyl-[2-[4-[octadecyl(phenylmethoxycarbonyl)amino]butoxy-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[4-[octadecyl(phenylmethoxycarbonyl)amino]butoxy-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[4-[benzyloxycarbonyl(octadecyl)amino]butoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[4-[octadecyl(phenylmethoxycarbonyl)amino]butoxy]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[4-[octadecyl(phenylmethoxycarbonyl)amino]butoxy]phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[4-[carbobenzoxy(stearyl)amino]butoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C35H66N2O6P+ MolecularWeight: 641.882101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCOP(=O)(O)OCC[N+](C)(C)C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCOP(=O)(O)OCC[N+](C)(C)C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C35H65N2O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-28-36(35(38)41-33-34-26-21-20-22-27-34)29-24-25-31-42-44(39,40)43-32-30-37(2,3)4/h20-22,26-27H,5-19,23-25,28-33H2,1-4H3/p+1