Compound Identification
SMILES
CCN(CC)CCN1C(C(=C(O)C2=C(C)C=C(OC)C=C2)C(=O)C1=O)C1=CC(Br)=CC=C1
InChIKey
InChIKey=FTTWFECPTHCYJC-UHFFFAOYSA-N
Formula
C25H29BrN2O4
Mass
501.421
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
Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Toluenes Bromobenzenes Aryl bromides Pyrrolidine-3-ones N-alkylpyrrolidines Pyrrolidine-2-ones Tertiary carboxylic acid amides Vinylogous acids Pyrroles Trialkylamines Amino acids and derivatives Lactams Cyclic ketones Enols Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - N-alkylpyrrolidine - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Cyclic ketone - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Lactam - Ketone - Carboxamide group - Azacycle - Ether - Enol - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organobromide - Amine - Organonitrogen compound - Organooxygen 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