Structure Information
Structure

Compound Identification

SMILES

COC1=NN(CC2=CC=C(Cl)C=C2)C(C)=C1[N+]([O-])=O

InChIKey

InChIKey=QDRPCXACGYBHGZ-UHFFFAOYSA-N

Formula

C12H12ClN3O3

Mass

281.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic 1,3-dipolar compounds

Class

Allyl-type 1,3-dipolar organic compounds

Subclass

Organic nitro compounds

Intermediate Tree Nodes

C-nitro compounds

Direct Parent

Nitroaromatic compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitroaromatic compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Azacycle - Organoheterocyclic compound - Ether - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Organohalogen compound - Organic salt - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.

External Descriptors

Not available

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