Compound Identification
SMILES
CCOC1=CC=CC=C1C1N(CC2=C[NH+]=CC=C2)C(=O)C(=O)C1=C([O-])C1=CC(C)=C(OC)C=C1
InChIKey
InChIKey=WHWFXTCBDFRXNV-UHFFFAOYSA-N
Formula
C27H26N2O5
Mass
458.514
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
Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Toluenes Pyrrolidine-3-ones Pyrrolidine-2-ones N-alkylpyrrolidines Pyridinium derivatives Vinylogous acids Tertiary carboxylic acid amides Heteroaromatic compounds Pyrroles Tertiary amines Lactams Amino acids and derivatives Cyclic ketones Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Pyridine - Pyridinium - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Vinylogous acid - Pyrrole - Heteroaromatic compound - Tertiary amine - Carboxamide group - Amino acid or derivatives - Cyclic ketone - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Amine - Organic zwitterion - Organic oxygen compound - Organic salt - 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