Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)N1CCC2=C(C1)SC1=C2C(=O)NC(N1)C1=CC(=C(O)C(OC)=C1)[N+]([O-])=O

InChIKey

InChIKey=VCGRZUMRDRDWSA-UHFFFAOYSA-N

Formula

C19H20N4O7S

Mass

448.45

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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 heteropolycyclic compounds

Substituents

Nitrophenyl ether - Nitrophenol - Methoxyphenol - Methoxyaniline - 3,4,5-trisubstituted-2-aminothiophene - Phenoxy compound - Methoxybenzene - Phenol ether - Nitroaromatic compound - Anisole - Phenol - Alkyl aryl ether - 2-aminothiophene - Vinylogous amide - Carbamic acid ester - Thiophene - Heteroaromatic compound - Carboxamide group - Lactam - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Ether - Carbonyl group - Organic oxygen compound - Organic oxide - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic salt - Organic zwitterion - Organooxygen compound - Aromatic heteropolycyclic 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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