Compound Identification
SMILES
CN1N=C(C=C1N1C(=O)C2CC3C4C(CC=C3C(C3=CC=C(CO)O3)C2(C)C1=O)C(=O)N(C4=O)C1=CC=CC(=C1)B(O)O)C1=C(C)C2=C(S1)C=CC(Cl)=C2
InChIKey
InChIKey=DGXZIBABPBVYKR-UHFFFAOYSA-N
Formula
C39H34BClN4O8S
Mass
765.04
Taxonomic Classification
Taxonomy Tree
-
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
Isoindolones 1-benzothiophenes N-substituted carboxylic acid imides Benzene and substituted derivatives Aryl chlorides Pyrrolidine-2-ones Dicarboximides Heteroaromatic compounds Furans Thiophenes Pyrazoles Pyrroles Boronic acids Lactams Azacyclic compounds Organic metalloid salts Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organometalloid compounds Organonitrogen compounds Aromatic alcohols Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Isoindolone - Isoindoline - 1-benzothiophene - Isoindole or derivatives - Benzothiophene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Pyrrolidone - 2-pyrrolidone - Azole - Heteroaromatic compound - Furan - Dicarboximide - Carboxylic acid imide - Pyrazole - Pyrrole - Thiophene - Boronic acid - Boronic acid derivative - Lactam - Carboxylic acid derivative - Organic metalloid salt - Oxacycle - Azacycle - Alcohol - Organohalogen compound - Organic metalloid moeity - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary alcohol - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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