Compound Identification
SMILES
COC(=O)C(=O)C1CCC2=C(N=C3NN(C(=O)C3=C12)C1=CC=CC=C1)C(=O)OC
InChIKey
InChIKey=CALCQCBQNLMHDS-UHFFFAOYSA-N
Formula
C20H17N3O6
Mass
395.371
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Pyridinecarboxylic acids Pyrazolopyridines Pyrazolones Benzene and substituted derivatives Alpha-keto acids and derivatives Vinylogous amides Methyl esters Heteroaromatic compounds Lactams Ketones Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Pyrazolopyridine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Alpha-keto acid - Monocyclic benzene moiety - Keto acid - Pyrazolinone - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Methyl ester - Carboxylic acid ester - Ketone - Lactam - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Carbonyl group - 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