Compound Identification
SMILES
CCOC1=CC=CC(=C1)C(O)=C1C(N(CC2=CN=CC=C2)C(=O)C1=O)C1=CC(OC)=C(O)C(Br)=C1
InChIKey
InChIKey=LQDQJVJVAXPVPT-UHFFFAOYSA-N
Formula
C26H23BrN2O6
Mass
539.382
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
Methoxyphenols Anisoles Methoxybenzenes O-bromophenols Phenoxy compounds Alkyl aryl ethers Bromobenzenes Aryl bromides Pyrrolidine-3-ones Pyrrolidine-2-ones N-alkylpyrrolidines Pyridines and derivatives Pyrroles Vinylogous acids Heteroaromatic compounds Tertiary carboxylic acid amides Lactams Cyclic ketones Enols Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Methoxyphenol - Phenoxy compound - Anisole - 2-bromophenol - 2-halophenol - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Bromobenzene - Phenol - Benzenoid - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - N-alkylpyrrolidine - Pyridine - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Vinylogous acid - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - Cyclic ketone - Lactam - Carboxamide group - Ketone - Azacycle - Carboxylic acid derivative - Enol - Ether - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - Aromatic heteromonocyclic 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