Compound Identification
SMILES
CC1=CN2C=C(NC(=O)C3=C(F)C=C(C=C3)C3=CCNCC3)C=C(F)C2=N1
InChIKey
InChIKey=WXDSFKVEUQARAL-UHFFFAOYSA-N
Formula
C20H18F2N4O
Mass
368.388
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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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
Halobenzoic acids and derivatives
Direct Parent
2-halobenzoic acids and derivatives
Alternative Parents
Benzamides Imidazo[1,2-a]pyridines Imidazopyridines Benzoyl derivatives Fluorobenzenes Aryl fluorides Hydropyridines N-substituted imidazoles Heteroaromatic compounds Vinylogous halides Amino acids and derivatives Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organooxygen compounds Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-halobenzoic acid or derivatives - Imidazo[1,2-a]pyridine - Benzamide - Imidazopyridine - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Hydropyridine - Pyridine - N-substituted imidazole - Azole - Heteroaromatic compound - Vinylogous halide - Imidazole - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary amine - Organoheterocyclic compound - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.
External Descriptors
Not available