Compound Identification
SMILES
COC1=CC=CC=C1N1CCN(CC1)S(=O)(=O)C1=CC2=C(NC=C(C(O)=O)C2=O)C=C1
InChIKey
InChIKey=BAIBKMDHDDTITQ-UHFFFAOYSA-N
Formula
C21H21N3O6S
Mass
443.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
- Subclass Quinoline carboxylic acids
-
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
Phenylpiperazines N-arylpiperazines Hydroquinolones Hydroquinolines Aminophenyl ethers Pyridinecarboxylic acids Methoxyanilines Phenoxy compounds Anisoles Dialkylarylamines Methoxybenzenes Alkyl aryl ethers Organosulfonamides Heteroaromatic compounds Vinylogous amides Sulfonyls Amino acids Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxylic acid - Phenylpiperazine - N-arylpiperazine - Dihydroquinolone - Dihydroquinoline - Aminophenyl ether - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Methoxyaniline - Methoxybenzene - Anisole - Aniline or substituted anilines - Dialkylarylamine - Phenoxy compound - Phenol ether - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Pyridine - Organosulfonic acid amide - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous amide - Tertiary amine - Amino acid or derivatives - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic oxide - 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