Compound Identification
SMILES
CCN1C=C(C(O)=O)C(=O)C2=CC(NCCC3=CC=C(OC)C=C3)=C(Cl)C=C12
InChIKey
InChIKey=JMGMXGRLMXHFPJ-UHFFFAOYSA-N
Formula
C21H21ClN2O4
Mass
400.86
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
Chloroquinolines Aminoquinolines and derivatives Hydroquinolones Hydroquinolines Pyridinecarboxylic acids Phenethylamines Methoxybenzenes Phenoxy compounds Anisoles Secondary alkylarylamines Alkyl aryl ethers Aralkylamines Aryl chlorides Heteroaromatic compounds Vinylogous amides Amino acids Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxylic acid - Aminoquinoline - Dihydroquinolone - Haloquinoline - Chloroquinoline - Dihydroquinoline - Phenethylamine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Aralkylamine - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Benzenoid - Pyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Amino acid - Amino acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Azacycle - Secondary amine - Organohalogen compound - Organic oxygen compound - Amine - Organooxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - 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