Compound Identification
SMILES
Cl.CCN(CCCCC(=O)OC)C1=C(CN(CC2=CC(=CC(=C2)C#N)C(F)(F)F)C2=NN(C)C=C2)C=C2CCCCC2=C1
InChIKey
InChIKey=ALUKQUBSTDCYKP-UHFFFAOYSA-N
Formula
C32H39ClF3N5O2
Mass
618.14
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
Trifluoromethylbenzenes Benzonitriles Benzylamines Dialkylarylamines Fatty acid methyl esters Imidolactams Pyrazoles Methyl esters Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Nitriles Monocarboxylic acids and derivatives Carbonyl compounds Organofluorides Organic oxides Alkyl fluorides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Trifluoromethylbenzene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Benzylamine - Benzonitrile - Fatty acid ester - Fatty acid methyl ester - Monocyclic benzene moiety - Fatty acyl - Imidolactam - Heteroaromatic compound - Azole - Pyrazole - Methyl ester - Carboxylic acid ester - Tertiary amine - Amino acid or derivatives - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Nitrile - Carboxylic acid derivative - Carbonitrile - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrochloride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - 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