Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(N=NC2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)=C(S1)N1CCOCC1

InChIKey

InChIKey=ZXHVKQNZEKFJCB-UHFFFAOYSA-N

Formula

C16H15N5O7S

Mass

421.38

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Dialkylarylamine - Morpholine - Oxazinane - 2-aminothiophene - Heteroaromatic compound - Thiophene - Methyl ester - Organic nitro compound - Azo compound - Carboxylic acid ester - C-nitro compound - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organic salt - Organic oxide - Organic zwitterion - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

Previous Back Next