Compound Identification
SMILES
CCCOC1=CC=C(C=C1)[C@H]1N(CCC[NH+]2CCOCC2)C(=O)C(=O)C1=C(O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=NEPCIGGMUHZOPH-XMMPIXPASA-O
Formula
C27H32BrN2O5
Mass
544.465
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 Bromobenzenes Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl bromides N-alkylpyrrolidines Morpholines Pyrroles Vinylogous acids Quaternary ammonium salts Tertiary carboxylic acid amides Trialkylamines Lactams Amino acids and derivatives Cyclic ketones Oxacyclic compounds Azacyclic compounds Dialkyl ethers Enols Hydrocarbon derivatives Organic oxides Organobromides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Quaternary ammonium salt - Tertiary carboxylic acid amide - Vinylogous acid - Pyrrole - Ketone - Lactam - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Cyclic ketone - Carboxamide group - Dialkyl ether - Enol - Ether - Carboxylic acid derivative - Azacycle - Oxacycle - Organic oxygen compound - Amine - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic cation - 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