[2-[9-(4-chloranylphenoxy)nonoxy-oxidanyl-phosphoryl]oxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium hydroxide

Systemtic Name: [2-[9-(4-chloranylphenoxy)nonoxy-oxidanyl-phosphoryl]oxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium hydroxide Openeye Name: [2-[9-(4-chlorophenoxy)nonoxy-hydroxy-phosphoryl]oxy-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium hydroxide CAS Name: [2-[9-(4-chlorophenoxy)nonoxy-hydroxyphosphoryl]oxy-4-hydroxy-4-oxobutyl]-trimethylammonium hydroxide IUPAC Name: [2-[9-(4-chlorophenoxy)nonoxy-hydroxyphosphoryl]oxy-4-hydroxy-4-oxobutyl]-trimethylazanium hydroxide Traditional Name: [2-[9-(4-chlorophenoxy)nonoxy-hydroxy-phosphoryl]oxy-4-hydroxy-4-keto-butyl]-trimethyl-ammonium hydroxide Formula: C22H39ClNO8P MolecularWeight: 511.973721

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCCCCCCOC1=CC=C(C=C1)Cl.[OH-]

Isomeric SMILES

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCCCCCCOC1=CC=C(C=C1)Cl.[OH-]

InChI

InChI=1S/C22H37ClNO7P.H2O/c1-24(2,3)18-21(17-22(25)26)31-32(27,28)30-16-10-8-6-4-5-7-9-15-29-20-13-11-19(23)12-14-20;/h11-14,21H,4-10,15-18H2,1-3H3,(H-,25,26,27,28);1H2