Compound Identification
SMILES
CC(=O)N1N=C(CC1C1=CC=C(O)C=C1)NC1=NN=C(CNC2=C(C=C(Br)C=C2)C(O)=O)O1
InChIKey
InChIKey=ANVKPKMZAKLTRP-UHFFFAOYSA-N
Formula
C21H19BrN6O5
Mass
515.324
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
Aminobenzoic acids and derivatives
- Level 6 Aminobenzoic acids
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Level 5
Aminobenzoic acids and derivatives
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Subclass
Benzoic acids and derivatives
-
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
Aminobenzoic acids and derivatives
Direct Parent
Aminobenzoic acids
Alternative Parents
3-halobenzoic acids Halobenzoic acids Benzoic acids Aniline and substituted anilines Phenylalkylamines Benzoyl derivatives Secondary alkylarylamines 1-hydroxy-2-unsubstituted benzenoids Bromobenzenes Aryl bromides Imidolactams Vinylogous amides Pyrazolines 1,3,4-oxadiazoles Heteroaromatic compounds Acetamides Amino acids Amidrazones Azacyclic compounds Oxacyclic compounds Amidines Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminobenzoic acid - 3-halobenzoic acid - Halobenzoic acid - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzoic acid - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Bromobenzene - Halobenzene - Phenol - Secondary aliphatic/aromatic amine - Aralkylamine - 1-hydroxy-2-unsubstituted benzenoid - Aryl halide - Imidolactam - Aryl bromide - 1,3,4-oxadiazole - Azole - Heteroaromatic compound - Oxadiazole - Pyrazoline - Acetamide - Vinylogous amide - Amino acid or derivatives - Amino acid - Carboxylic acid amidrazone - Organoheterocyclic compound - Secondary amine - Azacycle - Amidine - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organobromide - Carbonyl group - Organooxygen compound - Amine - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety.
External Descriptors
Not available