Compound Identification
SMILES
COC(=O)C=CC1=C(NCC2=CC=C(OC)C=C2)N=C2C=CC(Br)=CC2=C1
InChIKey
InChIKey=CXHCAFOVZZSWKY-UHFFFAOYSA-N
Formula
C21H19BrN2O3
Mass
427.298
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzylamines
- Level 5 2-benzylaminopyridines
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Subclass
Benzylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzylamines
Intermediate Tree Nodes
Not available
Direct Parent
2-benzylaminopyridines
Alternative Parents
Aminoquinolines and derivatives Haloquinolines Phenoxy compounds Anisoles Methoxybenzenes Secondary alkylarylamines Alkyl aryl ethers Aminopyridines and derivatives Fatty acid esters Aryl bromides Imidolactams Enoate esters Methyl esters Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-benzylaminopyridine - Haloquinoline - Aminoquinoline - Quinoline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aminopyridine - Fatty acid ester - Secondary aliphatic/aromatic amine - Aryl bromide - Aryl halide - Pyridine - Fatty acyl - Imidolactam - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Secondary amine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxide - Organohalogen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-benzylaminopyridines. These are aromatic compounds containing pyridine ring substituted at the 2-position by a benzylamine group.
External Descriptors
Not available