Compound Identification
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.COC[C@H](N1CCN(C[C@@H]1C)C1(C)CCN(CC1)C(=O)C1=C(C)N=CN=C1C)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=QWLGEYBSJQSEDG-RIAYWLAYSA-N
Formula
C34H46F3N5O9
Mass
725.763
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Tricarboxylic acids and derivatives Pyrimidinecarboxylic acids and derivatives N-acylpiperidines N-alkylpiperazines Aminopiperidines Aralkylamines Alpha hydroxy acids and derivatives Tertiary carboxylic acid amides Tertiary alcohols Heteroaromatic compounds Trialkylamines Amino acids and derivatives Dialkyl ethers Azacyclic compounds Carboxylic acids Alkyl fluorides Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Trifluoromethylbenzene - N-acyl-piperidine - Tricarboxylic acid or derivatives - Pyrimidine-5-carboxylic acid or derivatives - 4-aminopiperidine - Aralkylamine - N-alkylpiperazine - Alpha-hydroxy acid - Piperazine - Piperidine - 1,4-diazinane - Hydroxy acid - Pyrimidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary alcohol - Tertiary aliphatic amine - Carboxamide group - Amino acid or derivatives - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Azacycle - Ether - Organoheterocyclic compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available