Compound Identification
SMILES
ClC1=CC2=C(C=C1)C(=C1CCNCC1)C1=C(CO2)N=CC=C1
InChIKey
InChIKey=UMZALMPEZDMECE-UHFFFAOYSA-N
Formula
C18H17ClN2O
Mass
312.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxepines
Alternative Parents
Alkyl aryl ethers Pyridines and derivatives Piperidines Benzenoids Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Dialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxepine - Alkyl aryl ether - Aryl chloride - Aryl halide - Piperidine - Benzenoid - Pyridine - Heteroaromatic compound - Oxacycle - Secondary aliphatic amine - Ether - Azacycle - Secondary amine - Organohalogen compound - Amine - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxepines. These are organic compounds containing a benzene ring fused to an oxepine ring (an unsaturated seven-membered heterocycle with one oxygen atom replacing a carbon atom).
External Descriptors
Not available