Compound Identification
SMILES
COC1=C(C=CC(=C1)N(CCC#N)CCC#N)C(=NNC1=CC=C(C)C=C1)N=NC(=O)C1=C(O)C=CC(Br)=C1
InChIKey
InChIKey=BXYKDEOKVVEQLC-UHFFFAOYSA-N
Formula
C28H26BrN7O3
Mass
588.466
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
Benzoic acids and derivatives
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Level 5
Hydroxybenzoic acid derivatives
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Level 6
Salicylic acid and derivatives
- Level 7 Salicylamides
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Level 6
Salicylic acid and derivatives
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Level 5
Hydroxybenzoic acid derivatives
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Hydroxybenzoic acid derivatives - Salicylic acid and derivatives
Direct Parent
Salicylamides
Alternative Parents
3-halobenzoic acids and derivatives Aminophenyl ethers Methoxyanilines Benzoyl derivatives Dialkylarylamines Anisoles Methoxybenzenes P-bromophenols Phenoxy compounds Phenylhydrazines Toluenes Bromobenzenes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Vinylogous acids Formazans Amino acids and derivatives Azo compounds Propargyl-type 1,3-dipolar organic compounds Nitriles Hydrazones Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Salicylamide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Aminophenyl ether - Methoxyaniline - Phenol ether - Phenoxy compound - Phenylhydrazine - Anisole - Tertiary aliphatic/aromatic amine - Benzoyl - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - 4-bromophenol - 4-halophenol - Alkyl aryl ether - Phenol - Halobenzene - Toluene - Bromobenzene - 1-hydroxy-2-unsubstituted benzenoid - Aryl halide - Aryl bromide - Vinylogous acid - Formazan - Tertiary amine - Amino acid or derivatives - Azo compound - Carboxylic acid derivative - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrazone - Carbonitrile - Nitrile - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organooxygen compound - Amine - Organobromide - Organic oxygen compound - Cyanide - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as salicylamides. These are carboxamide derivatives of salicylic acid. Salicylic acid is the ortho-hydroxylated derivative of benzoic acid.
External Descriptors
Not available