Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)C1=C([O-])C1=CC=C(F)C=C1
InChIKey
InChIKey=RCDIUFKAHONCAL-UHFFFAOYSA-N
Formula
C26H29FN2O7
Mass
500.523
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
Methoxybenzenes Anisoles Phenoxy compounds Fluorobenzenes Alkyl aryl ethers Morpholines N-alkylpyrrolidines Aryl fluorides Pyrrolidine-3-ones Pyrrolidine-2-ones Tertiary carboxylic acid amides Quaternary ammonium salts Vinylogous acids Pyrroles Trialkylamines Cyclic ketones Amino acids and derivatives Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organofluorides Organic salts Organic oxides Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Fluorobenzene - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Aryl fluoride - Monocyclic benzene moiety - Benzenoid - Morpholine - Oxazinane - N-alkylpyrrolidine - Aryl halide - Quaternary ammonium salt - Pyrrole - Tertiary carboxylic acid amide - Vinylogous acid - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Organic zwitterion - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - 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