trimethyl-[4-oxidanyl-4-oxidanylidene-2-[oxidanyl-[4-(4-phenoxyphenoxy)butoxy]phosphoryl]oxy-butyl]azanium

Systemtic Name: trimethyl-[4-oxidanyl-4-oxidanylidene-2-[oxidanyl-[4-(4-phenoxyphenoxy)butoxy]phosphoryl]oxy-butyl]azanium Openeye Name: [4-hydroxy-2-[hydroxy-[4-(4-phenoxyphenoxy)butoxy]phosphoryl]oxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: [4-hydroxy-2-[hydroxy-[4-(4-phenoxyphenoxy)butoxy]phosphoryl]oxy-4-oxobutyl]-trimethylammonium IUPAC Name: [4-hydroxy-2-[hydroxy-[4-(4-phenoxyphenoxy)butoxy]phosphoryl]oxy-4-oxobutyl]-trimethylazanium Traditional Name: [4-hydroxy-2-[hydroxy-[4-(4-phenoxyphenoxy)butoxy]phosphoryl]oxy-4-keto-butyl]-trimethyl-ammonium Formula: C23H33NO8P+ MolecularWeight: 482.483781

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCOC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(C)CC(CC(=O)O)OP(=O)(O)OCCCCOC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C23H32NO8P/c1-24(2,3)18-22(17-23(25)26)32-33(27,28)30-16-8-7-15-29-19-11-13-21(14-12-19)31-20-9-5-4-6-10-20/h4-6,9-14,22H,7-8,15-18H2,1-3H3,(H-,25,26,27,28)/p+1