Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)NC1=NC(N)=C(C(NCC(=O)CN(C)C2=CC=C(Cl)C=C2)=C1)[N+]([O-])=O

InChIKey

InChIKey=GLGSUVPRWWODNL-UHFFFAOYSA-N

Formula

C18H21ClN6O5

Mass

436.85

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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

Tertiary aliphatic/aromatic amine - Nitroaromatic compound - Dialkylarylamine - Aniline or substituted anilines - Aminopyridine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Pyridine - Imidolactam - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Aryl halide - Heteroaromatic compound - Alpha-aminoketone - Carbamic acid ester - Carbonic acid derivative - Ketone - Tertiary amine - Organoheterocyclic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic oxide - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Amine - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - 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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