Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C)N=C2SC(=CC3=CC(OCC)=C(O)C(Cl)=C3)C(=O)N2C1C1=CC(=C(C)C=C1)[N+]([O-])=O

InChIKey

InChIKey=KKKOFIHYIASATE-UHFFFAOYSA-N

Formula

C26H24ClN3O7S

Mass

558.0

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 heteropolycyclic compounds

Substituents

Nitrobenzene - Nitrotoluene - Phenoxy compound - Nitroaromatic compound - 2-chlorophenol - 2-halophenol - Phenol ether - Alkyl aryl ether - Halobenzene - Chlorobenzene - Phenol - Toluene - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - Thiazole - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Organic nitro compound - Lactam - Carboxylic acid ester - C-nitro compound - Isothiourea - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Organic oxoazanium - Azacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic 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