Compound Identification
SMILES
COCC(=O)N(CC1=CC=CO1)[C@H]1C2=C(C=CC(F)=C2)C(=C)[C@H]2CCCN2C1=O
InChIKey
InChIKey=YQTWDVFANXELKO-CTNGQTDRSA-N
Formula
C22H23FN2O4
Mass
398.434
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzazepines
Alternative Parents
Alpha amino acids and derivatives Azepines Aryl fluorides Benzenoids Tertiary carboxylic acid amides Pyrrolidines Furans Heteroaromatic compounds Tertiary amines Lactams Azacyclic compounds Dialkyl ethers Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Alpha-amino acid or derivatives - Azepine - Aryl fluoride - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Furan - Amino acid or derivatives - Tertiary amine - Carboxamide group - Lactam - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Dialkyl ether - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).
External Descriptors
Not available