Compound Identification
SMILES
FC1=CC=CC(=C1)C(=O)NC12CC3CC(CC(C3)(C1)NC(=O)C1=CN3C=C(Cl)C=CC3=N1)C2
InChIKey
InChIKey=NXTRHAVRSMURHT-UHFFFAOYSA-N
Formula
C25H24ClFN4O2
Mass
466.94
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
3-halobenzoic acids and derivatives
Alternative Parents
Benzamides Imidazo[1,2-a]pyridines Pyridinecarboxamides Imidazopyridines 2-heteroaryl carboxamides Benzoyl derivatives Fluorobenzenes Carbonylimidazoles N-substituted imidazoles Aryl chlorides Aryl fluorides Heteroaromatic compounds Vinylogous amides Secondary carboxylic acid amides Azacyclic compounds Organochlorides Organic oxides Organooxygen compounds Hydrocarbon derivatives Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-halobenzoic acid or derivatives - Imidazo[1,2-a]pyridine - Imidazopyridine - Benzamide - Pyridinecarboxamide - 2-heteroaryl carboxamide - Benzoyl - Halobenzene - Fluorobenzene - Imidazole-4-carbonyl group - Aryl chloride - Aryl fluoride - Aryl halide - N-substituted imidazole - Pyridine - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors
Not available