Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C=CC2C3=CCC4C(C3CC3C(=O)N(NC5=CC=C(F)C=C5)C(=O)C23C2=CC=C(Cl)C=C2)C(=O)N(C4=O)C2=CC(=C(N(C)C)C(=C2)[N+]([O-])=O)[N+]([O-])=O)=CC(OC)=C1O

InChIKey

InChIKey=QUEWTJSXTBELAW-UHFFFAOYSA-N

Formula

C44H38ClFN6O11

Mass

881.27

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Aniline and substituted anilines

Intermediate Tree Nodes

Not available

Direct Parent

Dinitroanilines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dinitroaniline - 3-phenylpyrrolidine - 1-phenylpyrrolidine - Dimethoxybenzene - M-dimethoxybenzene - Methoxyphenol - Isoindolone - Nitrobenzene - Isoindole or derivatives - Isoindoline - Methoxybenzene - Styrene - Tertiary aliphatic/aromatic amine - Nitroaromatic compound - Dialkylarylamine - Phenol ether - Phenylhydrazine - Anisole - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Phenol - 2-pyrrolidone - Pyrrolidone - Aryl chloride - Aryl fluoride - Aryl halide - Carboxylic acid imide, n-substituted - Pyrrolidine - Pyrrole - Dicarboximide - Carboxylic acid imide - Amino acid or derivatives - Tertiary amine - Carboxylic acid hydrazide - Lactam - Organic nitro compound - C-nitro compound - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Organic salt - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dinitroanilines. These are organic compounds containing an aniline moiety, which is substituted at 2 positions by a nitro group.

External Descriptors

Not available

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