Structure Information
Structure

Compound Identification

SMILES

CCOC1=C(C=C(C=C2C(=O)NC(=O)N(C2=O)C2=CC=C(C=C2)[N+]([O-])=O)C=C1)C(O)=O

InChIKey

InChIKey=MSNCWUSAXLYJFD-UHFFFAOYSA-N

Formula

C20H15N3O8

Mass

425.353

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Pyrimidones

Direct Parent

Barbituric acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrobenzene - Barbiturate - Benzoic acid or derivatives - Benzoic acid - Phenoxy compound - Nitroaromatic compound - Phenol ether - Benzoyl - Alkyl aryl ether - Ureide - N-acyl urea - Monocyclic benzene moiety - Benzenoid - 1,3-diazinane - Dicarboximide - C-nitro compound - Carbonic acid derivative - Urea - Organic nitro compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as barbituric acid derivatives. These are compounds containing a perhydropyrimidine ring substituted at C-2, -4 and -6 by oxo groups.

External Descriptors

Not available

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