Compound Identification
SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.CN(C(C)=O)C1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I
InChIKey
InChIKey=TXKOGNLDVKUFSI-WZTVWXICSA-N
Formula
C19H28I3N3O9
Mass
823.158
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
Hexoses O-haloacetanilides P-haloacetanilides 2-halobenzoic acids 4-halobenzoic acids Halobenzoic acids Benzoic acids N-acetylarylamines 1-carboxy-2-haloaromatic compounds Benzoyl derivatives Iodobenzenes Aryl iodides Vinylogous halides Tertiary carboxylic acid amides 1,3-aminoalcohols Acetamides Secondary alcohols Secondary carboxylic acid amides 1,2-aminoalcohols Polyols Monocarboxylic acids and derivatives Dialkylamines Organopnictogen compounds Primary alcohols Organic oxides Hydrocarbon derivatives Organoiodides Carbonyl compounds
Molecular Framework
Not available
Substituents
Acylaminobenzoic acid or derivatives - Hexose monosaccharide - O-haloacetanilide - P-haloacetanilide - Haloacetanilide - 2-halobenzoic acid or derivatives - Acetanilide - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid - 4-halobenzoic acid - Halobenzoic acid - Benzoic acid - N-acetylarylamine - Anilide - 1-carboxy-2-haloaromatic compound - Benzoyl - N-arylamide - Iodobenzene - Halobenzene - Aryl iodide - Aryl halide - Monosaccharide - 1,3-aminoalcohol - Tertiary carboxylic acid amide - Acetamide - Vinylogous halide - 1,2-aminoalcohol - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Secondary amine - Polyol - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Amine - Alcohol - Organic oxygen compound - Carbonyl group - Primary alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - 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