Compound Identification
SMILES
CC1=CC(C(O)=O)=C(C=C1)[C@H](N)C1=NC(Cl)=NC2=CC=CC=C12
InChIKey
InChIKey=LFNJOHBVMVUKLD-AWEZNQCLSA-N
Formula
C17H14ClN3O2
Mass
327.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinazolines
Alternative Parents
Benzoic acids Benzoyl derivatives Toluenes Aralkylamines 2-halopyrimidines Aryl chlorides Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Organooxygen compounds Organochlorides Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Benzoic acid or derivatives - Benzoic acid - Benzoyl - 2-halopyrimidine - Halopyrimidine - Toluene - Aralkylamine - Aryl chloride - Benzenoid - Aryl halide - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid - Amino acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organochloride - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic nitrogen compound - Primary amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
External Descriptors
Not available