Compound Identification
SMILES
COC1=C2C3CNCC3CCC2=C(Br)C=C1
InChIKey
InChIKey=NQXLGQLJTRDWAD-UHFFFAOYSA-N
Formula
C13H16BrNO
Mass
282.181
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
Isoindolines Isoindoles Anisoles Aralkylamines Alkyl aryl ethers Aryl bromides Pyrrolidines Dialkylamines Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Isoindoline - Isoindole - Isoindole or derivatives - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Aryl bromide - Aryl halide - Pyrrolidine - Azacycle - Secondary aliphatic amine - Ether - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - 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