Compound Identification
SMILES
OC(=O)C1=CN2CC(SC3=C2C(=CC(F)=C3)C1=O)N1CCNCC1
InChIKey
InChIKey=QKWUQEZXWXBVJZ-UHFFFAOYSA-N
Formula
C16H16FN3O3S
Mass
349.38
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
Fluoroquinolones Haloquinolines Hydroquinolones Benzothiazines Hydroquinolines Pyridinecarboxylic acids Alkylarylthioethers N-alkylpiperazines Benzenoids Aryl fluorides 1,4-thiazines Heteroaromatic compounds Vinylogous amides Amino acids Dialkylamines Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organofluorides Organooxygen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxylic acid - Fluoroquinolone - Haloquinoline - Dihydroquinolone - Benzothiazine - Dihydroquinoline - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Aryl thioether - N-alkylpiperazine - Alkylarylthioether - Benzenoid - 1,4-diazinane - Piperazine - Aryl halide - Aryl fluoride - Pyridine - Para-thiazine - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Amino acid - Secondary amine - Thioether - Carboxylic acid derivative - Azacycle - Carboxylic acid - Secondary aliphatic amine - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organohalogen compound - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - 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