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

Systemtic Name: 2-[[1-[aminocarbonyl-(phenylmethyl)amino]-3-hexadecoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[1-[[benzyl(carbamoyl)amino]methyl]-2-hexadecoxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-[carbamoyl-(phenylmethyl)amino]-3-hexadecoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[1-[benzyl(carbamoyl)amino]-3-hexadecoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-[[benzyl(carbamoyl)amino]methyl]-2-cetyloxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C32H61N3O6P+ MolecularWeight: 614.817001

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H60N3O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-39-29-31(41-42(37,38)40-26-24-35(2,3)4)28-34(32(33)36)27-30-22-19-18-20-23-30/h18-20,22-23,31H,5-17,21,24-29H2,1-4H3,(H2-,33,36,37,38)/p+1