Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)NC1=C[C@H](C=NC2=C(C)C=C(C=C2)N(CC)CC)C(C)=C(Cl)C1=O

InChIKey

InChIKey=PXALOSRQFNJYSK-MRXNPFEDSA-N

Formula

C22H28ClN3O3

Mass

417.93

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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

Aromatic homomonocyclic compounds

Substituents

Tertiary aliphatic/aromatic amine - Aminotoluene - Aniline or substituted anilines - Dialkylarylamine - Alpha-haloketone - Alpha-chloroketone - Carbamic acid ester - Ketone - Carbonic acid derivative - Shiff base - Tertiary amine - Cyclic ketone - Aldimine - Chloroalkene - Vinyl chloride - Vinyl halide - Haloalkene - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Imine - Organic nitrogen compound - Organic oxygen compound - 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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