Compound Identification
SMILES
OC(=O)C(F)(F)F.O=c1ccc2CCN(Cc3ccoc3)CCc2n1CC1CCOCC1
InChIKey
InChIKey=OYTHGMSSPPWSTO-UHFFFAOYSA-N
Formula
C22H27F3N2O5
Mass
456.462
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Azepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Azepines
Alternative Parents
Pyridinones Aralkylamines Oxanes Alpha-halocarboxylic acids Heteroaromatic compounds Furans Trialkylamines Lactams Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkyl ethers Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Organopnictogen compounds Alkyl fluorides
Molecular Framework
Not available
Substituents
Azepine - Aralkylamine - Pyridinone - Oxane - Pyridine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Furan - Heteroaromatic compound - Lactam - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as azepines. These are organic compounds containing an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
External Descriptors
Not available