Compound Identification
SMILES
COC(=O)[C@@H](C#N)C1=C(C=C(C=C1)C(F)(F)F)[N+]([O-])=O
InChIKey
InChIKey=HDRIGUQRECFCAK-QMMMGPOBSA-N
Formula
C11H7F3N2O4
Mass
288.182
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Monoterpenoids
- Level 5 Aromatic monoterpenoids
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Subclass
Monoterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Aromatic monoterpenoids
Alternative Parents
Trifluoromethylbenzenes Monocyclic monoterpenoids Nitrobenzenes Nitroaromatic compounds Methyl esters Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Nitriles Organic oxoazanium compounds Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic salts Alkyl fluorides Organic oxides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Trifluoromethylbenzene - Monocyclic monoterpenoid - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Methyl ester - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Organic oxide - Organohalogen compound - Cyanide - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alkyl fluoride - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.
External Descriptors
Not available