Compound Identification
SMILES
CONC(=O)C1=CC(NC2=NC=NN3C=C(NC(=O)OCC4=CC=C(CN(C)C)O4)C(C(C)C)=C23)=C(F)C=C1F
InChIKey
InChIKey=CABYQXRGDRDCBT-UHFFFAOYSA-N
Formula
C26H29F2N7O5
Mass
557.559
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Not available
Direct Parent
Aminobenzoic acids and derivatives
Alternative Parents
2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Pyrrolo[2,1-f][1,2,4]triazines Aniline and substituted anilines Benzoyl derivatives Aralkylamines Fluorobenzenes 1,2,4-triazines Substituted pyrroles Imidolactams Aryl fluorides Vinylogous halides Heteroaromatic compounds Carbamate esters Furans Trialkylamines Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Pyrrolo[2,1-f][1,2,4]triazine - Benzoyl - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Aralkylamine - Aryl halide - Aryl fluoride - Substituted pyrrole - Triazine - 1,2,4-triazine - Imidolactam - Carbamic acid ester - Furan - Heteroaromatic compound - Pyrrole - Vinylogous halide - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organohalogen compound - Amine - Organofluoride - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids and derivatives. These are benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.
External Descriptors
Not available