Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(OC3=C(C=C(C#N)C4=CC=CC=C4C3C3=CC(=CC=C3)C(F)(F)F)C2=O)C=C1

InChIKey

InChIKey=MLQYPMRLHQGMNO-UHFFFAOYSA-N

Formula

C27H16F3NO2

Mass

443.425

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Cycloheptapyrans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cycloheptapyrans

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chromone - Cycloheptapyran - Benzopyran - Trifluoromethylbenzene - 1-benzopyran - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Nitrile - Carbonitrile - Oxacycle - Alkyl fluoride - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cycloheptapyrans. These are organic heterocyclic compounds containing a cycloheptane derivative fused to a pyran. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds.

External Descriptors

Not available

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