2-[[1-[aminocarbonyl-(phenylmethyl)amino]-3-icosoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[1-[aminocarbonyl-(phenylmethyl)amino]-3-icosoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[1-[[benzyl(carbamoyl)amino]methyl]-2-icosoxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-[carbamoyl-(phenylmethyl)amino]-3-eicosoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[1-[benzyl(carbamoyl)amino]-3-icosoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(arachyloxymethyl)-2-[benzyl(carbamoyl)amino]ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C36H69N3O6P+ MolecularWeight: 670.923321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOCC(CN(CC1=CC=CC=C1)C(=O)N)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOCC(CN(CC1=CC=CC=C1)C(=O)N)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C36H68N3O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-29-43-33-35(45-46(41,42)44-30-28-39(2,3)4)32-38(36(37)40)31-34-26-23-22-24-27-34/h22-24,26-27,35H,5-21,25,28-33H2,1-4H3,(H2-,37,40,41,42)/p+1