Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.NC1=NC=CC2=C1C=C(OCCNC(=O)C1=CC=C(C=C1)C(=N)N1CCCC1)C=C2

InChIKey

InChIKey=MUKYQVXBTXPFGE-UHFFFAOYSA-N

Formula

C25H26F3N5O4

Mass

517.509

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Not available

Substituents

Isoquinoline - Benzamide - Benzoic acid or derivatives - Benzoyl - Phenol ether - Aminopyridine - Alkyl aryl ether - Imidolactam - Benzenoid - Pyridine - Monocyclic benzene moiety - Alpha-halocarboxylic acid - Heteroaromatic compound - Pyrrolidine - Alpha-halocarboxylic acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Monocarboxylic acid or derivatives - Amidine - Ether - Carboxylic acid - Carboxylic acid derivative - Carboximidamide - Carboxylic acid amidine - Azacycle - Organic oxygen compound - Carbonyl group - Alkyl fluoride - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Amine - Organooxygen compound - Primary amine - Hydrocarbon derivative - Alkyl halide - Organic oxide - 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

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