trimethyl-[2-[8-(4-nitrophenoxy)octoxy-oxidanyl-phosphoryl]oxy-4-oxidanyl-4-oxidanylidene-butyl]azanium hydroxide

Systemtic Name: trimethyl-[2-[8-(4-nitrophenoxy)octoxy-oxidanyl-phosphoryl]oxy-4-oxidanyl-4-oxidanylidene-butyl]azanium hydroxide Openeye Name: [4-hydroxy-2-[hydroxy-[8-(4-nitrophenoxy)octoxy]phosphoryl]oxy-4-oxo-butyl]-trimethyl-ammonium hydroxide CAS Name: [4-hydroxy-2-[hydroxy-[8-(4-nitrophenoxy)octoxy]phosphoryl]oxy-4-oxobutyl]-trimethylammonium hydroxide IUPAC Name: [4-hydroxy-2-[hydroxy-[8-(4-nitrophenoxy)octoxy]phosphoryl]oxy-4-oxobutyl]-trimethylazanium hydroxide Traditional Name: [4-hydroxy-2-[hydroxy-[8-(4-nitrophenoxy)octoxy]phosphoryl]oxy-4-keto-butyl]-trimethyl-ammonium hydroxide Formula: C21H37N2O10P MolecularWeight: 508.499641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-].[OH-]

Isomeric SMILES

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-].[OH-]

InChI

InChI=1S/C21H35N2O9P.H2O/c1-23(2,3)17-20(16-21(24)25)32-33(28,29)31-15-9-7-5-4-6-8-14-30-19-12-10-18(11-13-19)22(26)27;/h10-13,20H,4-9,14-17H2,1-3H3,(H-,24,25,28,29);1H2