Compound Identification
SMILES
OCCONC(=O)C1=C(NC2=C(F)C=C(CC(O)CO)C=C2)C(F)=C(F)C=C1
InChIKey
InChIKey=WEOHZDGCPYJQGC-UHFFFAOYSA-N
Formula
C18H19F3N2O5
Mass
400.354
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
3-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Aniline and substituted anilines Benzoyl derivatives Fluorobenzenes Aryl fluorides Primary aromatic amines Vinylogous amides 1,2-diols Secondary alcohols Amino acids and derivatives Secondary amines Hydrocarbon derivatives Primary alcohols Organic oxides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aminobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Primary aromatic amine - Vinylogous amide - Secondary alcohol - Amino acid or derivatives - 1,2-diol - Secondary amine - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Alcohol - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic homomonocyclic 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