Compound Identification
SMILES
COC(=O)c1ccc(NC(=O)CN2CCC(CC2)Nc2cc(Oc3c(C)cc(C)cc3C)n3ncnc3n2)c(Cl)c1
InChIKey
InChIKey=VXEZNYZELNSMMB-UHFFFAOYSA-N
Formula
C29H32ClN7O4
Mass
578.07
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
Alpha amino acid amides Diarylethers 3-halobenzoic acids and derivatives Benzoic acid esters Triazolopyrimidines Anilides Benzoyl derivatives N-arylamides Phenol ethers Phenoxy compounds Aminopyrimidines and derivatives Secondary alkylarylamines Chlorobenzenes Aryl chlorides Piperidines Imidolactams Heteroaromatic compounds Triazoles Methyl esters Trialkylamines Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alpha-amino acid amide - Diaryl ether - Benzoate ester - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Alpha-amino acid or derivatives - Triazolopyrimidine - Anilide - Phenoxy compound - Benzoyl - Phenol ether - N-arylamide - Aminopyrimidine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Imidolactam - Piperidine - Pyrimidine - Heteroaromatic compound - Azole - Triazole - 1,2,4-triazole - Methyl ester - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid ester - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Azacycle - Secondary amine - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - 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