Compound Identification
SMILES
CCOC1=C(OC(C)C)C=CC(=C1)[C@H](N(N)C1=CC2=C(C=C1)C=NC=C2)C(=O)NCC1=CC=CC=C1C(F)(F)F
InChIKey
InChIKey=MKCJBVGKVCDWNN-NDEPHWFRSA-N
Formula
C30H31F3N4O3
Mass
552.598
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
Trifluoromethylbenzenes Phenylacetamides Alpha amino acids and derivatives Phenylhydrazines Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyridines and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Alkylhydrazines Azacyclic compounds Alkyl fluorides Organic oxides Organofluorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Trifluoromethylbenzene - Isoquinoline - Phenylacetamide - Phenoxy compound - Phenol ether - Phenylhydrazine - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Alkylhydrazine - Carboxylic acid derivative - Ether - Azacycle - Organohalogen compound - Hydrocarbon derivative - Hydrazine derivative - Alkyl halide - Alkyl fluoride - Organic oxide - Carbonyl group - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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