Compound Identification
SMILES
COC1=C(N)C(=O)C2=C(N3N=NN=C3C(=N2)C2=CC=CC=C2)C1=O
InChIKey
InChIKey=BJBRKRPXNMKWFP-UHFFFAOYSA-N
Formula
C15H10N6O3
Mass
322.284
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
- Level 6 Aryl ketones
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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
Direct Parent
Aryl ketones
Alternative Parents
Pyrazines Benzene and substituted derivatives Vinylogous esters Vinylogous amides Tetrazoles Heteroaromatic compounds Enamines Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl ketone - Monocyclic benzene moiety - Pyrazine - Benzenoid - Azole - Heteroaromatic compound - Tetrazole - Vinylogous ester - Vinylogous amide - Enamine - Azacycle - Organoheterocyclic compound - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryl ketones. These are organic aromatic compounds that contain a ketone group substituted at one C-atom with an aryl group. They have the generic structure RC(=O)R', where R = aryl group and R'=organyl group.
External Descriptors
Not available