Compound Identification
SMILES
CC1(C)N=C(N)N=C(N)N1NC(=O)C1=CC=C(F)C=C1
InChIKey
InChIKey=CWGNJNZJIAVVKD-UHFFFAOYSA-N
Formula
C12H15FN6O
Mass
278.291
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Halobenzoic acids and derivatives
Direct Parent
4-halobenzoic acids and derivatives
Alternative Parents
Benzoyl derivatives Aminotriazines Fluorobenzenes 1,3,5-triazines Aryl fluorides Carboxylic acid hydrazides Guanidines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organopnictogen compounds Organic oxides Organofluorides Organooxygen compounds Hydrocarbon derivatives Imines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-halobenzoic acid or derivatives - Benzoyl - Aminotriazine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Triazine - 1,3,5-triazine - Carboxylic acid hydrazide - Guanidine - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Hydrocarbon derivative - Imine - Organic oxide - Organohalogen compound - Organopnictogen compound - Organofluoride - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
External Descriptors
Not available