3-[(2-acetyloxy-5-methyl-icosoxy)-oxidanyl-phosphanyl]oxypropyl-methyl-azanium

Systemtic Name: 3-[(2-acetyloxy-5-methyl-icosoxy)-oxidanyl-phosphanyl]oxypropyl-methyl-azanium Openeye Name: 3-[(2-acetoxy-5-methyl-icosoxy)-hydroxy-phosphanyl]oxypropyl-methyl-ammonium CAS Name: 3-[(2-acetyloxy-5-methyleicosoxy)-hydroxyphosphino]oxypropyl-methylammonium IUPAC Name: 3-[(2-acetyloxy-5-methylicosoxy)-hydroxyphosphanyl]oxypropyl-methylazanium Traditional Name: 3-[(2-acetoxy-5-methyl-eicosoxy)-hydroxy-phosphino]oxypropyl-methyl-ammonium Formula: C27H57NO5P+ MolecularWeight: 506.718941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C)CCC(COP(O)OCCC[NH2+]C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(C)CCC(COP(O)OCCC[NH2+]C)OC(=O)C

InChI

InChI=1S/C27H56NO5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-25(2)20-21-27(33-26(3)29)24-32-34(30)31-23-18-22-28-4/h25,27-28,30H,5-24H2,1-4H3/p+1