Compound Identification
SMILES
CN1C=C(C(O)=O)C(=O)C2=CC(N)=C(C=C12)N1CCN(CC1)C1=NC2=CC=CC=C2N1
InChIKey
InChIKey=VGPZMODVMFEFRZ-UHFFFAOYSA-N
Formula
C22H22N6O3
Mass
418.457
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
N-arylpiperazines Aminoquinolines and derivatives Hydroquinolones Hydroquinolines Pyridinecarboxylic acids Benzimidazoles Dialkylarylamines Aminoimidazoles Benzenoids Vinylogous amides Heteroaromatic compounds Amino acids Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organooxygen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxylic acid - N-arylpiperazine - Aminoquinoline - Dihydroquinolone - Dihydroquinoline - Benzimidazole - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Aminoimidazole - 1,4-diazinane - Piperazine - Benzenoid - Pyridine - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Amino acid or derivatives - Amino acid - Tertiary amine - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Primary amine - Organic oxygen 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