Structure Information
Structure

Compound Identification

SMILES

IC1=CC=CC=C1C(=O)N1C(=S)S\C(=C/C2=CC=NC=C2)C1=O

InChIKey

InChIKey=UFBMLJICMSQRCN-LCYFTJDESA-N

Formula

C16H9IN2O2S2

Mass

452.28

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Halobenzoic acids and derivatives

Direct Parent

2-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-halobenzoic acid or derivatives - Benzoyl - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Carboxylic acid imide, n-substituted - Pyridine - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Thiazolidine - Dithiocarbamic acid ester - Vinylogous halide - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.

External Descriptors

Not available

Previous Back Next