Compound Identification
SMILES
OC1(CCN(CC\C=C2\C3=CC=CC=C3N(CC(=O)NCCN3CCOCC3)C(=O)C3=CC=CC=C23)CC1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=KWMJGGZVGZPNJI-GESPGMLMSA-N
Formula
C36H41ClN4O4
Mass
629.2
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzazepines
- Subclass Dibenzazepines
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Class
Benzazepines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Dibenzazepines
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzazepines
Alternative Parents
Phenylpiperidines Alpha amino acids and derivatives Aralkylamines Azepines Chlorobenzenes Aryl chlorides Morpholines Tertiary carboxylic acid amides Tertiary alcohols Trialkylamines Secondary carboxylic acid amides Lactams Azacyclic compounds Dialkyl ethers Oxacyclic compounds Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzazepine - Phenylpiperidine - Alpha-amino acid or derivatives - Chlorobenzene - Halobenzene - Azepine - Aralkylamine - Aryl chloride - Aryl halide - Morpholine - Monocyclic benzene moiety - Oxazinane - Piperidine - Benzenoid - Tertiary alcohol - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Azacycle - Dialkyl ether - Oxacycle - Ether - Carboxylic acid derivative - Alcohol - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzazepines. These are compounds with two benzene rings connected by an azepine ring. Azepine is an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
External Descriptors
Not available