Compound Identification
SMILES
CCCCOC1=C(OCC)C=C(C=C1)C1N(C(=O)C(=O)C1=C(O)C1=CC2=C(OCCO2)C=C1)C1=NC2=C(S1)C=C(F)C=C2
InChIKey
InChIKey=WPJPHTCLQNAJGG-UHFFFAOYSA-N
Formula
C32H29FN2O7S
Mass
604.65
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
Benzo-1,4-dioxanes Benzothiazoles Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Para dioxins Aryl fluorides Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Cyclic ketones Lactams Enols Oxacyclic compounds Azacyclic compounds Organic oxides Organofluorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzo-1,4-dioxane - Benzodioxane - 1,3-benzothiazole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Para-dioxin - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Azole - Pyrrole - Heteroaromatic compound - Vinylogous acid - Thiazole - Tertiary carboxylic acid amide - Cyclic ketone - Lactam - Ketone - Carboxamide group - Oxacycle - Azacycle - Ether - Enol - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic oxide - 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