Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(NC(=S)NC(NC(=O)C2=CC(Cl)=CC=C2)C(Cl)(Cl)Cl)C=C1)[N+]([O-])=O

InChIKey

InChIKey=NETHZKVUMYWGTC-UHFFFAOYSA-N

Formula

C17H14Cl4N4O4S

Mass

512.18

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrophenyl ethers

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Nitrophenyl ether - N-phenylthiourea - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Methoxyaniline - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - Benzoyl - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Secondary carboxylic acid amide - Organic nitro compound - C-nitro compound - Thiourea - Carboxamide group - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Organic oxoazanium - Organic zwitterion - Organic oxygen compound - Alkyl halide - Alkyl chloride - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organic oxide - Organochloride - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.

External Descriptors

Not available

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