Compound Identification
SMILES
CCN=C1COC2=CC=CC=C2C(=O)C1
InChIKey
InChIKey=DQWWFHMUFYNUOJ-UHFFFAOYSA-N
Formula
C12H13NO2
Mass
203.241
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
Aryl alkyl ketones Alkyl aryl ethers Benzenoids Secondary ketimines Azomethines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxepine - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Benzenoid - Azomethine - Secondary ketimine - Ketimine - Ketone - Ether - Oxacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Imine - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - 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