Compound Identification
SMILES
COC(=O)C1=C(C=CC=C1OC)N1N=C(C)C2=C1C=C(Br)C=C2
InChIKey
InChIKey=ZTPIWKOXJWCAOO-UHFFFAOYSA-N
Formula
C17H15BrN2O3
Mass
375.222
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
O-methoxybenzoic acids and derivatives Benzoic acid esters Indazoles Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Alkyl aryl ethers Aryl bromides Methyl esters Heteroaromatic compounds Vinylogous amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-methoxybenzoic acid or derivatives - Phenylpyrazole - Benzoate ester - Benzoic acid or derivatives - Benzopyrazole - Indazole - Methoxyaniline - Methoxybenzene - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Benzenoid - Methyl ester - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Ether - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organobromide - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available