Compound Identification
SMILES
COC1=CC(OC)=C(Cl)C=C1N1CC23OC(C=C2)C(C3C1=O)C(O)=O
InChIKey
InChIKey=AFQKCAKHRSIRMH-UHFFFAOYSA-N
Formula
C17H16ClNO6
Mass
365.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Dimethoxybenzenes Isoindolones Methoxyanilines Anisoles Furopyrroles Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Aryl chlorides Pyrrolidine-2-ones Tetrahydrofurans Dihydrofurans Tertiary carboxylic acid amides Furans Pyrroles Lactams Azacyclic compounds Dialkyl ethers Carboxylic acids Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - M-dimethoxybenzene - Dimethoxybenzene - Isoindolone - Isoindole or derivatives - Methoxyaniline - Isoindoline - Phenoxy compound - Anisole - Furopyrrole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - 2-pyrrolidone - Pyrrolidone - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Tetrahydrofuran - Tertiary carboxylic acid amide - Furan - Dihydrofuran - Pyrrole - Carboxamide group - Lactam - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Azacycle - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - 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