Compound Identification
SMILES
Cl.CCOC(=O)CCC(=O)N1CCC(CCC(=O)C2=CC3=C(CCN(CC4=CC=CC=C4)CC3)C=C2)CC1
InChIKey
InChIKey=XIEFEZHOGGBJHS-UHFFFAOYSA-N
Formula
C31H41ClN2O4
Mass
541.13
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 N-acylpiperidines Phenylmethylamines Aryl alkyl ketones Benzylamines Aralkylamines Fatty acid esters Azepines Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Hydrochlorides Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Butyrophenone - N-acyl-piperidine - Benzylamine - Aryl alkyl ketone - Aryl ketone - Phenylmethylamine - Fatty acid ester - Azepine - Aralkylamine - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Piperidine - Tertiary carboxylic acid amide - Carboxylic acid ester - Amino acid or derivatives - Ketone - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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