Compound Identification
SMILES
CN1C(=O)C=C(NCCNC2=C(C=C(C=C2)[N+]([O-])=O)C(=O)C2=CN=CC=C2)N(C)C1=O
InChIKey
InChIKey=HWUQAVGQLYLBRM-UHFFFAOYSA-N
Formula
C20H20N6O5
Mass
424.417
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Aryl-phenylketones
Alternative Parents
Nitrobenzenes Pyridinecarboxylic acids and derivatives Benzoyl derivatives Nitroaromatic compounds Aniline and substituted anilines Phenylalkylamines Aminopyrimidines and derivatives Pyrimidones Secondary alkylarylamines Hydropyrimidines Vinylogous amides Heteroaromatic compounds Lactams Ureas Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Nitrobenzene - Pyridine carboxylic acid or derivatives - Nitroaromatic compound - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Aminopyrimidine - Secondary aliphatic/aromatic amine - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Benzenoid - Pyridine - Heteroaromatic compound - Vinylogous amide - Lactam - Urea - Organic nitro compound - C-nitro compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic salt - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic zwitterion - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available