Structure Information
Structure

Compound Identification

SMILES

CCOC1=C(OCC2=CC=C(C=C2)[N+]([O-])=O)C=C(Br)C(C=C2C(=O)NC(=O)N(C3CCCCC3)C2=O)=C1

InChIKey

InChIKey=HEPXHXCSTKPACV-UHFFFAOYSA-N

Formula

C26H26BrN3O7

Mass

572.412

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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 - Phenoxy compound - Nitroaromatic compound - Phenol ether - Halobenzene - Bromobenzene - Alkyl aryl ether - Benzenoid - N-acyl-amine - 1,3-diazinane - Monocyclic benzene moiety - Dicarboximide - Organic nitro compound - Carbonic acid derivative - C-nitro compound - Azacycle - Bromoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Vinyl halide - Vinyl bromide - Organic oxoazanium - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organobromide - Organic hyponitrite - Organohalogen 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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