Compound Identification
SMILES
OC(=O)C(F)(F)F.CC(=N)N1CCC(CC1)OC1=CC=C(C=C1)C(=O)NCCOC1=CC2=C(C=CN=C2N)C=C1
InChIKey
InChIKey=MBYWZRABRZHADV-UHFFFAOYSA-N
Formula
C27H30F3N5O5
Mass
561.562
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 Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Aminopyridines and derivatives Piperidines Imidolactams Alpha-halocarboxylic acids Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carboxamidines Carboximidamides Alkyl fluorides Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic oxides Primary amines
Molecular Framework
Not available
Substituents
Isoquinoline - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Aminopyridine - Monocyclic benzene moiety - Imidolactam - Piperidine - Pyridine - Benzenoid - Heteroaromatic compound - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxylic acid amidine - Amidine - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Carboximidamide - Carboxylic acid - Organic oxide - Carbonyl group - Alkyl fluoride - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Amine - Organooxygen compound - Primary amine - Hydrocarbon derivative - Alkyl halide - 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