Compound Identification
SMILES
[Cl-].CNC(=O)C1=C(I)C(C[N+](C)(CC(O)CO)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)=C(I)C(NC(C)=O)=C1I
InChIKey
InChIKey=PUVYNKNURRAWLH-CKOJLFTCSA-N
Formula
C21H33ClI3N3O9
Mass
887.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
O-haloacetanilides P-haloacetanilides 2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Benzamides N-acetylarylamines Phenylmethylamines Benzylamines Benzoyl derivatives Aralkylamines Iodobenzenes Monosaccharides Aryl iodides Vinylogous halides Tetraalkylammonium salts Acetamides 1,3-aminoalcohols Secondary alcohols Secondary carboxylic acid amides 1,2-aminoalcohols Polyols Carbonyl compounds Hydrocarbon derivatives Organic chloride salts Organic oxides Organic zwitterions Organoiodides Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - O-haloacetanilide - P-haloacetanilide - Haloacetanilide - 2-halobenzoic acid or derivatives - Acetanilide - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - N-acetylarylamine - Anilide - Benzamide - Benzoyl - Benzylamine - N-arylamide - Phenylmethylamine - Aralkylamine - Halobenzene - Iodobenzene - Aryl halide - Monosaccharide - Aryl iodide - Quaternary ammonium salt - Acetamide - Vinylogous halide - 1,3-aminoalcohol - Tetraalkylammonium salt - 1,2-aminoalcohol - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Polyol - Carboxylic acid derivative - Organoiodide - Amine - Alcohol - Organic zwitterion - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available