Compound Identification
SMILES
OC(C1CCC(F)(F)C1)(C(=O)N1CC2CCCNCC2C1)C1=CC=CC=C1
InChIKey
InChIKey=RVSGQVUMOZQLQT-UHFFFAOYSA-N
Formula
C21H28F2N2O2
Mass
378.464
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrroloazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroloazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloazepines
Alternative Parents
Phenylacetamides N-acylpyrrolidines Azepanes Tertiary carboxylic acid amides Tertiary alcohols Amino acids and derivatives Dialkylamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylacetamide - Pyrroloazepine - N-acylpyrrolidine - Azepane - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Tertiary alcohol - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Secondary amine - Secondary aliphatic amine - Alcohol - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloazepines. These are compounds containing a pyrroloazepine moiety, which is a bicyclic heterocycle which consists of a pyrrole ring fused to an azepine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Azepine is a 7-membered ring consisting of six carbon and one nitrogen atom.
External Descriptors
Not available