Structure Information
Structure

Compound Identification

SMILES

[O-]S([O-])(=O)=O.CC1=CC(Br)=C(NCC(O)CN=C(N)[NH3+])C=C1.CC1=CC(Br)=C(NCC(O)CN=C(N)[NH3+])C=C1

InChIKey

InChIKey=WTDZIJYGJNILTC-UHFFFAOYSA-N

Formula

C22H36Br2N8O6S

Mass

700.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Toluenes

Intermediate Tree Nodes

Not available

Direct Parent

Aminotoluenes

Alternative Parents

Molecular Framework

Not available

Substituents

2-bromoaniline - Aniline or substituted anilines - Phenylalkylamine - Aminotoluene - Bromobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Organic sulfate salt - Aryl bromide - Aryl halide - Organic sulfuric acid or derivatives - 1,2-aminoalcohol - Guanidine - Secondary alcohol - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Secondary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Amine - Organohalogen compound - Alcohol - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic oxygen compound - Organopnictogen compound - Organic oxide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.

External Descriptors

Not available

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