Compound Identification
SMILES
CCC1=CC(NC2=CC=CC=C2C(F)(F)F)=C(C=C1C(Cl)=O)S(C)(=O)=O
InChIKey
InChIKey=HSQLVVNFICEZFD-UHFFFAOYSA-N
Formula
C17H15ClF3NO3S
Mass
405.82
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
Trifluoromethylbenzenes Benzenesulfonyl compounds Benzoyl derivatives Aniline and substituted anilines Primary aromatic amines Sulfones Secondary amines Acyl chlorides Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - Aminobenzoic acid or derivatives - Benzenesulfonyl group - Benzoyl - Aniline or substituted anilines - Primary aromatic amine - Sulfonyl - Sulfone - Acyl chloride - Acyl halide - Secondary amine - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - 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