Compound Identification
SMILES
OC(=O)C(F)(F)F.NC1=NC=CC2=C1C=CC=C2OCCNC(=O)C1=CC=C(C=C1)C(=O)N1CCCC1
InChIKey
InChIKey=ZHKPIRZAOOBWAV-UHFFFAOYSA-N
Formula
C25H25F3N4O5
Mass
518.493
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolines and derivatives
Alternative Parents
Benzamides Phenol ethers N-acylpyrrolidines Benzoyl derivatives Alkyl aryl ethers Aminopyridines and derivatives Imidolactams Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Alkyl fluorides Primary amines Organic oxides Hydrocarbon derivatives Organofluorides Carbonyl compounds
Molecular Framework
Not available
Substituents
Isoquinoline - Benzamide - Benzoic acid or derivatives - Benzoyl - N-acylpyrrolidine - Phenol ether - Alkyl aryl ether - Aminopyridine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyridine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrolidine - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Monocarboxylic acid or derivatives - Azacycle - Ether - Carboxylic acid - Carboxylic acid derivative - Primary amine - Carbonyl group - Organic nitrogen compound - Alkyl halide - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
External Descriptors
Not available