Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C(=O)N1CCC(CCN2CCC(CC2)NC2=NC3=CC=CC=C3N2CCC#N)(C1)C1=CC(F)=C(F)C=C1
InChIKey
InChIKey=LTFBHRGYJRFZRA-UHFFFAOYSA-N
Formula
C37H42F2N6O4
Mass
672.778
Taxonomic Classification
Taxonomy Tree
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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
Benzamides Benzimidazoles Anisoles Benzoyl derivatives Methoxybenzenes N-acylpyrrolidines Phenoxy compounds Fluorobenzenes Aralkylamines Alkyl aryl ethers N-substituted imidazoles Aryl fluorides Aminoimidazoles Piperidines Heteroaromatic compounds Tertiary carboxylic acid amides Pyrroles Amino acids and derivatives Trialkylamines Nitriles Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrolidine - Benzoic acid or derivatives - Benzimidazole - Benzamide - Phenoxy compound - Benzoyl - Anisole - N-acylpyrrolidine - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Halobenzene - Fluorobenzene - Monocyclic benzene moiety - Piperidine - Benzenoid - N-substituted imidazole - Aryl halide - Aryl fluoride - Aminoimidazole - Pyrrole - Tertiary carboxylic acid amide - Imidazole - Azole - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Carboxylic acid derivative - Azacycle - Ether - Nitrile - Carbonitrile - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - 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