Compound Identification
SMILES
[O-]S(=O)(=O)C(F)(F)F.CCOC(=O)C1=NN(C(O1)=C1C=CC(C=C1)=[O+]C)C1=CC=CC=C1
InChIKey
InChIKey=PURADXFADTXJBQ-UHFFFAOYSA-M
Formula
C19H17F3N2O7S
Mass
474.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 P-quinomethanes
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Level 7
Quinomethanes
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinomethanes
Direct Parent
P-quinomethanes
Alternative Parents
Trifluoromethanesulfonates Benzene and substituted derivatives Sulfonyls Organosulfonic acids Methanesulfonates Trihalomethanes Carboxylic acid esters Ketene acetals Azacyclic compounds Oxacyclic compounds Hydrazones Monocarboxylic acids and derivatives Hydrocarbon derivatives Alkyl fluorides Organofluorides Organic salts Organopnictogen compounds Organic oxides
Molecular Framework
Not available
Substituents
Trifluoromethanesulfonate - P-quinomethane - Monocyclic benzene moiety - Benzenoid - Methanesulfonate - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Trihalomethane - Carboxylic acid ester - Ketene acetal or derivatives - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrazone - Monocarboxylic acid or derivatives - Organic salt - Organonitrogen compound - Organofluoride - Organohalogen compound - Organosulfur compound - Alkyl fluoride - Organopnictogen compound - Alkyl halide - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Halomethane - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.
External Descriptors
Not available