Compound Identification
SMILES
CC1=C(Cl)C=C2C(OC=C(\C=N\NC(=O)C3=CC=C(Br)C=C3)C2=O)=C1
InChIKey
InChIKey=XWPAJTAXKZRALQ-ODCIPOBUSA-N
Formula
C18H12BrClN2O3
Mass
419.66
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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Subclass
1-benzopyrans
- Level 5 Chromones
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Subclass
1-benzopyrans
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Class
Benzopyrans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
Chromones
Alternative Parents
4-halobenzoic acids and derivatives Benzoyl derivatives Pyranones and derivatives Bromobenzenes Aryl chlorides Aryl bromides Heteroaromatic compounds Oxacyclic compounds Carboxylic acids and derivatives Organooxygen compounds Organonitrogen compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chromone - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Pyranone - Bromobenzene - Halobenzene - Benzenoid - Aryl bromide - Pyran - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.
External Descriptors
Not available