Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Phthalazines

Direct Parent

Phthalazinones

Alternative Parents

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

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