Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC(\C=C2/SC(=O)N(CC3=CC=C(C=C3)[N+]([O-])=O)C2=O)=CC(=C1O)[N+]([O-])=O

InChIKey

InChIKey=VDKRKRMLCWCXMJ-SXGWCWSVSA-N

Formula

C19H15N3O8S

Mass

445.4

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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 heteromonocyclic compounds

Substituents

Nitrophenyl ether - Nitrophenol - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Phenol - Thiazolidinedione - Dicarboximide - Thiazolidine - C-nitro compound - Organic nitro compound - Thiocarbamic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Ether - Organic oxoazanium - Organic salt - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic zwitterion - Aromatic heteromonocyclic 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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