Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C(=NC1=CC=CC=C1)N(SC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C1=CC=C(C)C=C1

InChIKey

InChIKey=QOWGEDWPLZXVSC-UHFFFAOYSA-N

Formula

C27H22N4O5S

Mass

514.56

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 homomonocyclic compounds

Substituents

Nitrobenzene - Anisole - Phenol ether - Methoxybenzene - Nitroaromatic compound - Phenoxy compound - Alkyl aryl ether - Toluene - Organic nitro compound - C-nitro compound - Ether - Organic oxoazanium - Amidine - Organic 1,3-dipolar compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organic salt - Organic nitrogen compound - Aromatic homomonocyclic 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