Compound Identification
SMILES
COC1=NC(=NC2=C1C=C(Br)C=C2)C1=CC=C(CP(=O)(OC)OC)C=C1
InChIKey
InChIKey=OLBDDNBEEWUQAA-UHFFFAOYSA-N
Formula
C18H18BrN2O4P
Mass
437.23
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinazolines
Alternative Parents
Dialkyl alkylphosphonates Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Phosphonic acid esters Benzene and substituted derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organophosphorus compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - Alkyl aryl ether - Dialkyl alkylphosphonate - Phosphonic acid diester - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Phosphonic acid ester - Pyrimidine - Benzenoid - Organophosphonic acid derivative - Heteroaromatic compound - Ether - Azacycle - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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