Compound Identification
SMILES
CCOC1=CC=C(NC2=NC3=CC=CC=C3N3C(C4=C(N=C23)N(N=C4C)C2=CC=CC=C2)C2=CC(=CC=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=KYAMLCVITBOMNT-UHFFFAOYSA-N
Formula
C33H27N7O3
Mass
569.625
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
Quinoxalines Pyrazolopyrimidines Nitrobenzenes Phenoxy compounds Phenol ethers Aniline and substituted anilines Nitroaromatic compounds Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Imidolactams Heteroaromatic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Carboxamidines Azacyclic compounds Organic salts Hydrocarbon derivatives Organic zwitterions Amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Quinoxaline - Nitrobenzene - Pyrazolopyrimidine - Phenoxy compound - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Monocyclic benzene moiety - Imidolactam - Pyrimidine - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid amidine - Ether - Organic oxoazanium - Azacycle - Amidine - Organic 1,3-dipolar compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic salt - Organic nitrogen compound - Organic zwitterion - 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