Compound Identification
SMILES
CC1(C)[C@@H](O)[C@H](OC2=NNC(=O)C=C2)C2=C(C=CC(=C2)C#N)C1=O
InChIKey
InChIKey=FZOZPCFRJGWQBW-ZBFHGGJFSA-N
Formula
C17H15N3O4
Mass
325.324
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
Aryl alkyl ketones Pyridazinones Alkyl aryl ethers Heteroaromatic compounds Secondary alcohols Lactams Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Pyridazinone - Pyridazine - Heteroaromatic compound - Ketone - Lactam - Secondary alcohol - Nitrile - Carbonitrile - Ether - Azacycle - Organoheterocyclic compound - Organic oxide - Cyanide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available