Compound Identification
SMILES
OC(=O)C(F)(F)F.CCC1=C(C(O)=O)C(C2=CC=NC=C2)=C2C=C(\C=C3/SC(NC4=C(Cl)C=CC=C4Cl)=NC3=O)C=CC2=N1
InChIKey
InChIKey=PFNHEVZJPXSPNP-GNWMQEPYSA-N
Formula
C29H19Cl2F3N4O5S
Mass
663.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
- Subclass Quinoline carboxylic acids
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Class
Quinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Quinoline carboxylic acids
Intermediate Tree Nodes
Not available
Direct Parent
Quinoline carboxylic acids
Alternative Parents
Bipyridines and oligopyridines Pyridinecarboxylic acids Aniline and substituted anilines Dichlorobenzenes Aryl chlorides Thiazolines Alpha-halocarboxylic acids Heteroaromatic compounds N-acylimines Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Alkyl fluorides Organochlorides Carbonyl compounds Amines Organofluorides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Quinoline-3-carboxylic acid - Bipyridine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - 1,3-dichlorobenzene - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Benzenoid - Aryl halide - Aryl chloride - Pyridine - Monocyclic benzene moiety - Alpha-halocarboxylic acid - Meta-thiazoline - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - N-acylimine - Isothiourea - Azacycle - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Alkyl fluoride - Organooxygen compound - Alkyl halide - Carbonyl group - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinoline carboxylic acids. These are quinolines in which the quinoline ring system is substituted by a carboxyl group at one or more positions.
External Descriptors
Not available