Structure Information
Structure

Compound Identification

SMILES

CCN[C@@H](C)[C@@H]1CCN(C1)C1=C(F)C=C2C(=O)C(=CN(C3CC3)C2=C1OC)C(O)=O

InChIKey

InChIKey=XJGDTVIRKPYDHZ-QWHCGFSZSA-N

Formula

C22H28FN3O4

Mass

417.481

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Quinoline-3-carboxylic acid - Fluoroquinolone - Haloquinoline - Aminoquinoline - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Anisole - Methylpyridine - Hydroxypyridine - Tetrahydropyridine - Short-chain keto acid - Heterocyclic fatty acid - Halogenated fatty acid - Branched fatty acid - Beta-keto acid - Alkyl aryl ether - Fatty acyl - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Unsaturated fatty acid - Pyridine - Keto acid - Beta-hydroxy ketone - Beta-aminoketone - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated ketone - Pyrrolidine - Enone - Acryloyl-group - Amino acid - Tertiary aliphatic amine - Tertiary amine - Ketone - Amino acid or derivatives - Azacycle - Fluoroalkene - Haloalkene - Vinyl halide - Vinyl fluoride - Secondary amine - Monocarboxylic acid or derivatives - Ether - Enamine - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - 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

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