Compound Identification
SMILES
[O-]C(=O)\C=C/C([O-])=O.C(OC1=NN=CC2=CC=CC=C12)C1=CC=CC=N1
InChIKey
InChIKey=XLPVLWOIHWEAOJ-BTJKTKAUSA-L
Formula
C18H13N3O5
Mass
351.319
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
-
Subclass
Benzodiazines
-
Level 5
Phthalazines
- Level 6 Phthalazinones
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Level 5
Phthalazines
-
Subclass
Benzodiazines
-
Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Phthalazines
Direct Parent
Phthalazinones
Alternative Parents
Alkyl aryl ethers Unsaturated fatty acids Pyridines and derivatives Pyridazines and derivatives Dicarboxylic acids and derivatives Benzenoids Heteroaromatic compounds Carboxylic acid salts Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic anions
Molecular Framework
Not available
Substituents
Phthalazinone - Alkyl aryl ether - Dicarboxylic acid or derivatives - Pyridazine - Pyridine - Unsaturated fatty acid - Benzenoid - Fatty acid - Fatty acyl - Heteroaromatic compound - Carboxylic acid salt - Carboxylic acid derivative - Ether - Carboxylic acid - Azacycle - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phthalazinones. These are compounds containing a phthalazine bearing a ketone group.
External Descriptors
Not available