Compound Identification
SMILES
CC1=NN(C(Cl)=C1C(=O)OCC(=O)C1=CC2=C(OCCO2)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=ZORQQZPVBZANSW-UHFFFAOYSA-N
Formula
C21H17ClN2O5
Mass
412.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
-
Subclass
Pyrazoles
-
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
Benzo-1,4-dioxanes Pyrazole carboxylic acids and derivatives Aryl alkyl ketones Alkyl aryl ethers Para dioxins Aryl chlorides Benzene and substituted derivatives Vinylogous halides Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Benzo-1,4-dioxane - Benzodioxane - Pyrazole-4-carboxylic acid or derivatives - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Para-dioxin - Benzenoid - Heteroaromatic compound - Vinylogous amide - Vinylogous halide - Ketone - Carboxylic acid ester - Ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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