Compound Identification
SMILES
COC1=C(OC)C=C(C(=C)NNC(=O)C2=CC=C(Br)C=C2)C(=C1)C1CC(=O)N(C1=O)C1=CC=CC=C1
InChIKey
InChIKey=OOBXVNIGYKCNGP-UHFFFAOYSA-N
Formula
C27H24BrN3O5
Mass
550.409
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
4-halobenzoic acids and derivatives Dimethoxybenzenes Styrenes Anisoles Benzoyl derivatives Phenoxy compounds Bromobenzenes Alkyl aryl ethers N-substituted carboxylic acid imides Pyrrolidine-2-ones Aryl bromides Dicarboximides Pyrroles Lactams Carboxylic acid hydrazides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - 3-phenylpyrrolidine - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Benzoic acid or derivatives - Benzoyl - Phenol ether - Phenoxy compound - Anisole - Styrene - Methoxybenzene - Halobenzene - Alkyl aryl ether - Bromobenzene - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Pyrrole - Carboxylic acid imide - Dicarboximide - Lactam - Carboxylic acid hydrazide - Azacycle - Carboxylic acid derivative - Ether - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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