Compound Identification
SMILES
CCN(CC)CCN1CCC(CCC(=O)C2=CC3=C(CCCN(CC4=CC=C(F)C=C4)C3)C=C2)CC1
InChIKey
InChIKey=NTYGLQNISOUWFX-UHFFFAOYSA-N
Formula
C31H44FN3O
Mass
493.711
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
Butyrophenones Phenylmethylamines Benzylamines Aryl alkyl ketones Fluorobenzenes Azepines Aralkylamines Piperidines Aryl fluorides Trialkylamines Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Butyrophenone - Benzylamine - Phenylmethylamine - Aryl ketone - Aryl alkyl ketone - Aralkylamine - Azepine - Fluorobenzene - Halobenzene - Aryl halide - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Piperidine - Tertiary aliphatic amine - Tertiary amine - Ketone - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Amine - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organohalogen compound - Organofluoride - Organonitrogen 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