Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(O)=C1C(N(C(=O)C1=O)C1=NN=C(SCC2=CC=CC3=CC=CC=C23)S1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=FXOWUSHPEZALTA-UHFFFAOYSA-N
Formula
C32H24BrN3O5S2
Mass
674.58
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
Dimethoxybenzenes Naphthalenes Anisoles Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Bromobenzenes Aryl bromides Pyrrolidine-3-ones Pyrrolidine-2-ones Tertiary carboxylic acid amides Heteroaromatic compounds Thiadiazoles Vinylogous acids Pyrroles Lactams Cyclic ketones Enols Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Naphthalene - Dimethoxybenzene - O-dimethoxybenzene - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Azole - Vinylogous acid - Heteroaromatic compound - Pyrrole - Thiadiazole - Tertiary carboxylic acid amide - Cyclic ketone - Ketone - Lactam - Carboxamide group - Thioether - Sulfenyl compound - Enol - Ether - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Aromatic heteropolycyclic 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