Compound Identification
SMILES
CC(=O)N1CCN(CC2=CC3=C(OCCN(CC4=CC5=C(OCO5)C=C4Cl)C3)C=C2)CC1
InChIKey
InChIKey=SEAIWHUGYMPBGU-UHFFFAOYSA-N
Formula
C24H28ClN3O4
Mass
457.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazepines
Alternative Parents
Benzodioxoles Alkyl aryl ethers N-alkylpiperazines Aralkylamines Benzenoids Aryl chlorides Tertiary carboxylic acid amides Acetamides Trialkylamines Amino acids and derivatives Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Benzodioxole - Alkyl aryl ether - N-alkylpiperazine - Aralkylamine - Benzenoid - Piperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Acetamide - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Oxacycle - Azacycle - Acetal - Carboxylic acid derivative - Ether - Organopnictogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazepines. These are organic compounds containing a benzene fused to an oxazepine ring (a seven-membered ring with four carbon atoms, one oxygen atom, and a nitrogen atom).
External Descriptors
Not available