2-[2-[(4-chlorophenyl)carbamoyloxy]icosoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2-[(4-chlorophenyl)carbamoyloxy]icosoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2-[(4-chlorophenyl)carbamoyloxy]icosoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2-[(4-chloroanilino)-oxomethoxy]eicosoxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[2-[(4-chlorophenyl)carbamoyloxy]icosoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[2-[(4-chlorophenyl)carbamoyloxy]eicosoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C32H59ClN2O6P+ MolecularWeight: 634.247421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C32H58ClN2O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-31(28-40-42(37,38)39-27-26-35(2,3)4)41-32(36)34-30-24-22-29(33)23-25-30/h22-25,31H,5-21,26-28H2,1-4H3,(H-,34,36,37,38)/p+1