Compound Identification
SMILES
C[N+](C)(C)CCOP(O)(=O)OC1=CC(=C(C=C1)[N+]([O-])=O)C(F)(F)F
InChIKey
InChIKey=VSLFZZKSQNMFBC-UHFFFAOYSA-O
Formula
C12H17F3N2O6P
Mass
373.244
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
-
Level 5
Cholines
- Level 6 Phosphocholines
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Level 5
Cholines
-
Subclass
Quaternary ammonium salts
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Quaternary ammonium salts
Intermediate Tree Nodes
Cholines
Direct Parent
Phosphocholines
Alternative Parents
Trifluoromethylbenzenes Nitrobenzenes Phenoxy compounds Nitroaromatic compounds Monoalkyl phosphates Tetraalkylammonium salts Organic oxoazanium compounds Organooxygen compounds Organofluorides Organic salts Organic oxides Hydrocarbon derivatives Amines Alkyl fluorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phosphocholine - Trifluoromethylbenzene - Nitrobenzene - Nitroaromatic compound - Phenoxy compound - Monoalkyl phosphate - Monocyclic benzene moiety - Benzenoid - Organic phosphoric acid derivative - Alkyl phosphate - Phosphoric acid ester - Tetraalkylammonium salt - C-nitro compound - Organic nitro compound - Organic oxoazanium - Organic oxygen compound - Alkyl halide - Organooxygen compound - Organofluoride - Organic salt - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Amine - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phosphocholines. These are compounds containing a [2-(trimethylazaniumyl)ethoxy]phosphonic acid or derivative.
External Descriptors
Not available