Compound Identification
SMILES
COC1=CC2=C(C=C1)C=C(C=C2)C1=CC(=NN1[C@H](C)C1=CC=C(C=C1)C(=O)NCCC(O)=O)C1=C(OC(F)(F)F)C=CC(Cl)=C1
InChIKey
InChIKey=MNKLXTAGRYRTRF-LJQANCHMSA-N
Formula
C33H27ClF3N3O5
Mass
638.04
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
Beta amino acids and derivatives Naphthalenes Benzamides Anisoles Phenoxy compounds Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Trihalomethanes Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Organic oxides Organochlorides Organofluorides Organonitrogen compounds Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Phenylpyrazole - Naphthalene - Benzoic acid or derivatives - Benzamide - Phenoxy compound - Phenol ether - Anisole - Benzoyl - Alkyl aryl ether - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Trihalomethane - Secondary carboxylic acid amide - Carboxamide group - Monocarboxylic acid or derivatives - Ether - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Alkyl halide - Carbonyl group - Organooxygen compound - Alkyl fluoride - Organonitrogen compound - Hydrocarbon derivative - Halomethane - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organofluoride - Organochloride - 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