Compound Identification
SMILES
CC1=C(CC2=CC=CC=C2)N2N=C(C)C3=C(OC(C(O)=O)C(=O)C3=O)C2=C1N
InChIKey
InChIKey=ZTQAELBQOTWRNS-UHFFFAOYSA-N
Formula
C20H17N3O5
Mass
379.372
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
Alkyl aryl ethers Substituted pyrroles Pyridazines and derivatives Primary aromatic amines 1,3-dicarbonyl compounds Benzene and substituted derivatives Heteroaromatic compounds Amino acids Cyclic ketones Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Aldehydes Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Primary aromatic amine - Pyridazine - Substituted pyrrole - Benzenoid - 1,3-dicarbonyl compound - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Amino acid - Cyclic ketone - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Amine - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Aldehyde - 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