2-[[1-[(4-chlorophenyl)carbamoylamino]-3-icosoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[1-[(4-chlorophenyl)carbamoylamino]-3-icosoxy-propan-2-yl]oxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[1-[[(4-chlorophenyl)carbamoylamino]methyl]-2-icosoxy-ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[1-[[(4-chloroanilino)-oxomethyl]amino]-3-eicosoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[1-[(4-chlorophenyl)carbamoylamino]-3-icosoxypropan-2-yl]oxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[1-(arachyloxymethyl)-2-[(4-chlorophenyl)carbamoylamino]ethoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C35H66ClN3O6P+ MolecularWeight: 691.341801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOCC(CNC(=O)NC1=CC=C(C=C1)Cl)OP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOCC(CNC(=O)NC1=CC=C(C=C1)Cl)OP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C35H65ClN3O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-28-43-31-34(45-46(41,42)44-29-27-39(2,3)4)30-37-35(40)38-33-25-23-32(36)24-26-33/h23-26,34H,5-22,27-31H2,1-4H3,(H2-,37,38,40,41,42)/p+1