Compound Identification
SMILES
CC(=O)[O-][B+3]1([O-]C(C)=O)[O-]C(=O)C2=CN(C3CC3)C3=CC(Cl)=C(F)C=C3C2=[O]1
InChIKey
InChIKey=PMDGGVYRTUUAAV-UHFFFAOYSA-N
Formula
C17H14BClFNO7
Mass
409.56
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 Hydroquinolones Hydroquinolines Tricarboxylic acids and derivatives Tertiary alkylarylamines Aryl ketones Tetrahydropyridines Beta-keto acids and derivatives Beta-amino ketones Benzenoids Alpha-branched alpha,beta-unsaturated ketones Vinylogous amides Enones Acryloyl compounds Acetate salts Trialkylamines Amino acids and derivatives Vinyl fluorides Vinyl chlorides Oxacyclic compounds Organic metalloid salts Fluoroalkenes Enamines Chloroalkenes Azacyclic compounds Organopnictogen compounds Organofluorides Organochlorides Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxylic acid - Fluoroquinolone - Quinolone - Dihydroquinolone - Dihydroquinoline - Tricarboxylic acid or derivatives - Aryl ketone - Tertiary aliphatic/aromatic amine - Tetrahydropyridine - Beta-keto acid - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Keto acid - Beta-aminoketone - Acetate salt - Vinylogous amide - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid salt - Amino acid or derivatives - Oxacycle - Azacycle - Organic metalloid salt - Fluoroalkene - Chloroalkene - Haloalkene - Vinyl halide - Vinyl fluoride - Vinyl chloride - Enamine - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Amine - 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