Compound Identification
SMILES
OC1=CC2=CC=CC=C2C=C1C(=O)OCC(=O)N1CCN(CC1)C1=NC=CC=N1
InChIKey
InChIKey=XVJVBANBTLUOMY-UHFFFAOYSA-N
Formula
C21H20N4O4
Mass
392.415
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
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Subclass
Naphthalenecarboxylic acids and derivatives
- Level 5 Naphthalenecarboxylic acids
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Subclass
Naphthalenecarboxylic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalenecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenecarboxylic acids
Alternative Parents
N-arylpiperazines Naphthols and derivatives Salicylic acid and derivatives Dialkylarylamines Aminopyrimidines and derivatives 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalenecarboxylic acid - N-arylpiperazine - 2-naphthol - Salicylic acid or derivatives - Dialkylarylamine - Aminopyrimidine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - 1,4-diazinane - Piperazine - Pyrimidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous acid - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available