Compound Identification
SMILES
CC1=CC(NC2=C(Cl)C(=O)N(N=C2)C23CC4CC(CC(CC(O)=O)(C4)C2)C3)=CC=C1
InChIKey
InChIKey=MYHMNMCNLRAFQV-UHFFFAOYSA-N
Formula
C23H26ClN3O3
Mass
427.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
- Level 5 Aminotoluenes
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Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Aminotoluenes
Alternative Parents
Aniline and substituted anilines Pyridazinones Aminopyridazines Primary aromatic amines Aryl chlorides Vinylogous amides Heteroaromatic compounds Amino acids Lactams Secondary amines Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aniline or substituted anilines - Aminotoluene - Aminopyridazine - Pyridazinone - Aryl chloride - Aryl halide - Primary aromatic amine - Pyridazine - Heteroaromatic compound - Vinylogous amide - Amino acid - Amino acid or derivatives - Lactam - Organoheterocyclic compound - Secondary amine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic 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