Compound Identification
SMILES
CCN(CC)CCCN1C(C(=C(O)C2=C(C)C=CC(C)=C2)C(=O)C1=O)C1=CC=C(OC)C=C1
InChIKey
InChIKey=LRPNCNBXLKITDD-UHFFFAOYSA-N
Formula
C27H34N2O4
Mass
450.579
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
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
p-Xylenes Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers N-alkylpyrrolidines Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Tertiary carboxylic acid amides Pyrroles Lactams Cyclic ketones Amino acids and derivatives Trialkylamines Enols Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - P-xylene - Xylene - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Pyrrolidone - Benzenoid - 2-pyrrolidone - N-alkylpyrrolidine - 3-pyrrolidone - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Cyclic ketone - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Lactam - Ketone - Azacycle - Carboxylic acid derivative - Ether - Enol - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen 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