Compound Identification
SMILES
COC1C(OCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(C)(C)OC2=C1C=C(NCC1=CC=CC=C1C)C=C2
InChIKey
InChIKey=HULLHWOZDGKJSV-UHFFFAOYSA-N
Formula
C29H29F6NO3
Mass
553.545
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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Subclass
1-benzopyrans
- Level 5 2,2-dimethyl-1-benzopyrans
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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
2,2-dimethyl-1-benzopyrans
Alternative Parents
Trifluoromethylbenzenes Benzylethers Phenylmethylamines Benzylamines Toluenes Secondary alkylarylamines Aralkylamines Alkyl aryl ethers Oxacyclic compounds Dialkyl ethers Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,2-dimethyl-1-benzopyran - Trifluoromethylbenzene - Benzylether - Benzylamine - Phenylmethylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aralkylamine - Toluene - Monocyclic benzene moiety - Benzenoid - Oxacycle - Ether - Dialkyl ether - Secondary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2,2-dimethyl-1-benzopyrans. These are organic compounds containing a 1-benzopyran moiety that carries two methyl groups at the 2-position.
External Descriptors
Not available