Compound Identification
SMILES
CC12C[C@@H](COC3=NC=NC(=C3)C(F)(F)F)C(C)(O1)[C@H]1[C@@H]2C(=O)N(C1=O)C1=CC(=C(C=C1)C#N)C(F)(F)F
InChIKey
InChIKey=XSFNXBSPZMVGPZ-SJMNQTGHSA-N
Formula
C24H18F6N4O4
Mass
540.422
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Trifluoromethylbenzenes Isoindolones Benzonitriles Alkyl aryl ethers Pyrrolidine-2-ones Pyrimidines and pyrimidine derivatives N-substituted carboxylic acid imides Pyrroles Oxolanes Dicarboximides Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Nitriles Carbonyl compounds Alkyl fluorides Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Isoindolone - Trifluoromethylbenzene - Isoindole or derivatives - Isoindoline - Benzonitrile - Alkyl aryl ether - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Pyrimidine - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrrole - Oxolane - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Lactam - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Carbonitrile - Nitrile - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Cyanide - Carbonyl group - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available