Compound Identification
SMILES
OC(=O)C(=C/NC1CC1)\C(=O)C1=CC(F)=C(F)C=C1[N+]([O-])=O
InChIKey
InChIKey=DYMVYSQFGKKINJ-YVMONPNESA-N
Formula
C13H10F2N2O5
Mass
312.229
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Phenylpropanoic acids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Phenylpropanoic acids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanoic acids
Alternative Parents
Nitrobenzenes Aryl ketones Benzoyl derivatives Nitroaromatic compounds Beta-keto acids and derivatives Fluorobenzenes Alpha-branched alpha,beta-unsaturated ketones Aryl fluorides Beta-hydroxy ketones Acryloyl compounds Vinylogous amides Enones Amino acids Allylamines Enamines Dialkylamines Carboxylic acids Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Organic oxides Organic salts Organofluorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aryl ketone - Halobenzene - Fluorobenzene - Beta-keto acid - Keto acid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Beta-hydroxy ketone - Acryloyl-group - Vinylogous amide - Alpha,beta-unsaturated ketone - Enone - Amino acid - Organic nitro compound - C-nitro compound - Ketone - Amino acid or derivatives - Allylamine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Enamine - Allyl-type 1,3-dipolar organic compound - Secondary amine - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organofluoride - Carbonyl group - Organohalogen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors
Not available