Compound Identification
SMILES
CCCOC1=CC=CC(=C1)C(O)=C1C(N(CCCN2CCOCC2)C(=O)C1=O)C1=CC(Br)=CC=C1
InChIKey
InChIKey=GOEQEFWISQGTGD-UHFFFAOYSA-N
Formula
C27H31BrN2O5
Mass
543.458
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
Phenol ethers Phenoxy compounds Alkyl aryl ethers Bromobenzenes Aryl bromides Morpholines N-alkylpyrrolidines Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Tertiary carboxylic acid amides Pyrroles Amino acids and derivatives Lactams Cyclic ketones Trialkylamines Enols Dialkyl ethers Oxacyclic compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenol ether - Phenoxy compound - Halobenzene - Alkyl aryl ether - Bromobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Pyrrole - Vinylogous acid - Lactam - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Carboxamide group - Ketone - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Enol - Ether - Organic oxygen compound - Organooxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - 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