Compound Identification
SMILES
COC1=C(C=CC(=C1)N(CCC#N)CCC#N)C(=NNC1=CC=C(C=C1)[N+]([O-])=O)N=NC(=O)C1=C(O)C=CC(Br)=C1
InChIKey
InChIKey=CXDJUIPWWWIXQK-UHFFFAOYSA-N
Formula
C27H23BrN8O5
Mass
619.436
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
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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 Methoxyanilines Nitrobenzenes Aminophenyl ethers Dialkylarylamines Methoxybenzenes Benzoyl derivatives Nitroaromatic compounds Anisoles Phenylhydrazines P-bromophenols Phenoxy compounds Bromobenzenes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Formazans Vinylogous acids Amino acids and derivatives Azo compounds Nitriles Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Hydrazones Organobromides Organic oxides Organic salts Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Salicylamide - Aminophenyl ether - Methoxyaniline - Nitrobenzene - 4-halophenol - 4-bromophenol - Phenol ether - Phenylhydrazine - Methoxybenzene - Nitroaromatic compound - Aniline or substituted anilines - Dialkylarylamine - Benzoyl - Tertiary aliphatic/aromatic amine - Phenoxy compound - Anisole - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Halobenzene - Phenol - Aryl bromide - Aryl halide - Vinylogous acid - Formazan - Tertiary amine - Organic nitro compound - Azo compound - Amino acid or derivatives - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Ether - Hydrazone - Carbonitrile - Nitrile - Organic oxoazanium - Organonitrogen compound - Organic salt - Organic zwitterion - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Cyanide - Organohalogen compound - Amine - 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