Compound Identification
SMILES
OC(=O)C1=CC=CC=C1NC1=C(NC2=C(C=C(CN(CC3=CC=CC=C3)CC3=CC=CC=C3)C=C2)C(O)=O)C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=KRVJSYPJHXWNFU-UHFFFAOYSA-N
Formula
C36H30F3N3O4
Mass
625.648
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Aminobenzoic acids and derivatives
- Level 6 Aminobenzoic acids
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Level 5
Aminobenzoic acids and 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
Aminobenzoic acids and derivatives
Direct Parent
Aminobenzoic acids
Alternative Parents
Trifluoromethylbenzenes Benzoic acids Aniline and substituted anilines Benzoyl derivatives Phenylmethylamines Benzylamines Aralkylamines Primary aromatic amines Vinylogous amides Trialkylamines Amino acids Carboxylic acids Secondary amines Organic oxides Hydrocarbon derivatives Organooxygen compounds Alkyl fluorides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aminobenzoic acid - Trifluoromethylbenzene - Benzoic acid - Benzoyl - Benzylamine - Phenylmethylamine - Aniline or substituted anilines - Aralkylamine - Primary aromatic amine - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Amino acid - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Alkyl halide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety.
External Descriptors
Not available