Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CN=C2SN(C(=O)C2=C1)C1=CC=C(Br)C=C1

InChIKey

InChIKey=APCZVVNESMLVLD-UHFFFAOYSA-N

Formula

C12H6BrN3O3S

Mass

352.16

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic 1,3-dipolar compounds

Class

Allyl-type 1,3-dipolar organic compounds

Subclass

Organic nitro compounds

Intermediate Tree Nodes

C-nitro compounds

Direct Parent

Nitroaromatic compounds

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitroaromatic compound - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Azole - Thiazole - Lactam - Organoheterocyclic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organobromide - Organopnictogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.

External Descriptors

Not available

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