Compound Identification
SMILES
F[B-](F)(F)F.OCCC[NH+]=C1C=C(OC2=C1C=C(Cl)C=C2)C1=CC=CC=C1
InChIKey
InChIKey=KZDQTKDFDHWOAJ-UHFFFAOYSA-O
Formula
C18H17BClF4NO2
Mass
401.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
- Subclass 1-benzopyrans
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Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Benzene and substituted derivatives Aryl chlorides Secondary ketimines Heteroaromatic compounds Oxacyclic compounds Organic metalloid salts Alkanolamines Primary alcohols Organochlorides Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Secondary ketimine - Heteroaromatic compound - Oxacycle - Alkanolamine - Organic metalloid salt - Organic zwitterion - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors
Not available