Compound Identification
SMILES
OC(=O)C(F)(F)F.O=C(C[C@@H]1COC[C@H]2CN(C[C@@H]12)C(=O)c1cccnc1)N1CCCC1
InChIKey
InChIKey=CMYUHHUBZBFSJB-QEFLZESTSA-N
Formula
C21H26F3N3O5
Mass
457.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids and derivatives
Alternative Parents
N-acylpyrrolidines Oxanes Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Alkyl fluorides Organonitrogen compounds Organic oxides Organofluorides
Molecular Framework
Not available
Substituents
Pyridine carboxylic acid or derivatives - N-acylpyrrolidine - Oxane - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof.
External Descriptors
Not available