Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.C[C@H]1C[C@@H]1CN1C(C)=C(C)C2=CN=NC(OCC3=CC=C(F)C=C3)=C12
InChIKey
InChIKey=IQHJTRXXLHTTPO-OTGJSXQYSA-N
Formula
C24H26FN3O5
Mass
455.486
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Fluorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Fluorobenzenes
Alternative Parents
Alkyl aryl ethers Unsaturated fatty acids Substituted pyrroles Pyridazines and derivatives Dicarboxylic acids and derivatives Aryl fluorides Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Alkyl aryl ether - Fluorobenzene - Aryl fluoride - Aryl halide - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Pyridazine - Unsaturated fatty acid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
External Descriptors
Not available