Compound Identification
SMILES
CCCN(CCN1C[C@@H]([C@H]([C@@H]1C1=CC=C(OC)C=C1)C(O)=O)C1=CC2=C(OCO2)C=C1)S(=O)(=O)C1=CC=C(OC)C=C1
InChIKey
InChIKey=JVNJDJVEVXFMRX-XUEBXJBISA-N
Formula
C31H36N2O8S
Mass
596.7
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Benzenesulfonamides Benzenesulfonyl compounds Benzodioxoles Pyrrolidine carboxylic acids Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Aralkylamines Organosulfonamides N-alkylpyrrolidines Pyrroles Aminosulfonyl compounds Trialkylamines Amino acids Acetals Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzenesulfonamide - Benzodioxole - Benzenesulfonyl group - Anisole - Phenoxy compound - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Organosulfonic acid amide - Aminosulfonyl compound - Pyrrole - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary aliphatic amine - Amino acid or derivatives - Amino acid - Tertiary amine - Acetal - Ether - Carboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Oxacycle - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Amine - 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