Compound Identification
SMILES
C[NH+]1CC=C2[C@H](C1)[C@H](C1=CC(Br)=C(F)C=C1)C(C#N)(C#N)C(=N)C2C#N
InChIKey
InChIKey=AZDPANAGHTWTIQ-HUUYTVAOSA-O
Formula
C19H16BrFN5
Mass
413.274
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Fluorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Fluorobenzenes
Alternative Parents
Bromobenzenes Aralkylamines Aryl fluorides Aryl bromides Quaternary ammonium salts Trialkylamines Ketimines Nitriles Azacyclic compounds Organofluorides Organobromides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aralkylamine - Bromobenzene - Fluorobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Quaternary ammonium salt - Tertiary aliphatic amine - Tertiary amine - Ketimine - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Amine - Organic nitrogen compound - Organohalogen compound - Organobromide - Organofluoride - Imine - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Cyanide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
External Descriptors
Not available