Compound Identification
SMILES
CCCCCCCCCCCCOC(=O)C(C)CC1=CC(NC(=O)C(N2N=NC3=C2C=CC(C)=C3)C(=O)NC2=C(Cl)C=CC(=C2)C(=O)OC(C)C(=O)OCCCCCCCCCCCC)=C(Cl)C=C1
InChIKey
InChIKey=YMSYAUHXHDGJER-UHFFFAOYSA-N
Formula
C54H75Cl2N5O8
Mass
993.12
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
4-halobenzoic acids and derivatives Benzoic acid esters Anilides Phenylpropanes Benzotriazoles N-arylamides Benzoyl derivatives Chlorobenzenes Fatty acid esters 1,3-dicarbonyl compounds Aryl chlorides Dicarboxylic acids and derivatives Triazoles Heteroaromatic compounds Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Phenylpropane - Anilide - Benzotriazole - N-arylamide - Benzoyl - Halobenzene - Fatty acid ester - Chlorobenzene - 1,3-dicarbonyl compound - Aryl halide - Aryl chloride - Dicarboxylic acid or derivatives - Fatty acyl - Azole - 1,2,3-triazole - Triazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic 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