Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=CC(=O)OCC(=O)NC2=C(Cl)C=C(C=N2)C(F)(F)F)C=C1
InChIKey
InChIKey=BWKDMEGWSSORGX-UHFFFAOYSA-N
Formula
C17H11ClF3N3O5
Mass
429.74
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
Nitrobenzenes Styrenes N-arylamides Nitroaromatic compounds Fatty acid esters Aryl chlorides Imidolactams Pyridines and derivatives Enoate esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic salts Alkyl fluorides Organic zwitterions Organochlorides Organofluorides Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid ester - Nitrobenzene - Nitroaromatic compound - Styrene - N-arylamide - Fatty acid ester - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Imidolactam - Fatty acyl - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Heteroaromatic compound - Organic nitro compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organohalogen compound - Organic oxygen compound - Organic zwitterion - Carbonyl group - Organic nitrogen compound - Alkyl halide - Organic salt - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available