Compound Identification
SMILES
OC1=C(C=CC2=CC=CC=C12)N1C(=O)C(Cl)C11C(C#N)C2=NC3=CC=CC=C3N2C1=O
InChIKey
InChIKey=LLHDQDBYIYSKRG-UHFFFAOYSA-N
Formula
C23H13ClN4O3
Mass
428.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Naphthols and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthols and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthols and derivatives
Alternative Parents
Alpha amino acids and derivatives Benzimidazoles N-acylimidazoles 1-hydroxy-4-unsubstituted benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Beta lactams Azetidines Nitriles Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthol - Alpha-amino acid or derivatives - Benzimidazole - N-acylimidazole - 1-hydroxy-4-unsubstituted benzenoid - Phenol - N-substituted imidazole - Azole - Beta-lactam - Heteroaromatic compound - Imidazole - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carbonitrile - Nitrile - Organooxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organonitrogen compound - Organochloride - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthols and derivatives. These are naphthalene derivatives carrying one or more hydroxyl (-OH) groups at any ring position.
External Descriptors
Not available