Compound Identification
SMILES
COC1=CC2=NC3=C(C=C2C=C1)C(N)=NN3C(=O)C1=CC=C(F)C=C1
InChIKey
InChIKey=ZQTBEKXRSLAOOC-UHFFFAOYSA-N
Formula
C18H13FN4O2
Mass
336.326
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoyl derivatives
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Level 5
Benzoylpyrazoles
- Level 6 N-benzoylpyrazoles
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Level 5
Benzoylpyrazoles
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Subclass
Benzoyl derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Benzoylpyrazoles
Direct Parent
N-benzoylpyrazoles
Alternative Parents
Aminoquinolines and derivatives 4-halobenzoic acids and derivatives Pyrazolopyridines Anisoles Alkyl aryl ethers Fluorobenzenes Pyridines and derivatives Imidolactams Aryl fluorides Pyrazoles Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzoylpyrazole - Aminoquinoline - Quinoline - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Pyrazolopyridine - Anisole - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Imidolactam - Aryl fluoride - Pyridine - Aryl halide - Heteroaromatic compound - Azole - Pyrazole - Ether - Azacycle - Organoheterocyclic compound - Organofluoride - Organohalogen compound - Primary amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzoylpyrazoles. These are aromatic heterocyclic compounds containing a pyrazole ring that is N-substituted at the 1-position by a benzoyl group.
External Descriptors
Not available