Compound Identification
SMILES
FC1=C(Cl)C=C(Cl)C(=C1)C(=O)OCC(=O)C(C#N)=C1NC2=CC=CC=C2N1
InChIKey
InChIKey=FZNWFTCZQTWKDW-UHFFFAOYSA-N
Formula
C18H10Cl2FN3O3
Mass
406.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
2-halobenzoic acids and derivatives 3-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Benzimidazoles Benzoyl derivatives Dichlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Enones Vinylogous amides Vinylogous halides Acryloyl compounds Ketones Carboxylic acid esters Ketene acetals Nitriles Azacyclic compounds Organic oxides Organochlorides Amines Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Benzimidazole - Benzoyl - 1,3-dichlorobenzene - Fluorobenzene - Halobenzene - Chlorobenzene - Aryl halide - Aryl fluoride - Aryl chloride - Enone - Vinylogous amide - Vinylogous halide - Acryloyl-group - Ketene acetal or derivatives - Ketone - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Nitrile - Carbonitrile - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organochloride - Organohalogen compound - Organic oxygen compound - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available