Compound Identification
SMILES
COC1=C(OC)C=C2CC(=O)N(CCCN(C)CC(O)CC3=CC(Cl)=C(N)C(Cl)=C3)CCC2=C1
InChIKey
InChIKey=AGCJSFSBIBGLFQ-UHFFFAOYSA-N
Formula
C25H33Cl2N3O4
Mass
510.46
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
Aniline and substituted anilines Anisoles Dichlorobenzenes Alkyl aryl ethers Aralkylamines Azepines Aryl chlorides Tertiary carboxylic acid amides Lactams Secondary alcohols Amino acids and derivatives 1,2-aminoalcohols Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Anisole - Aniline or substituted anilines - 1,3-dichlorobenzene - Phenol ether - Alkyl aryl ether - Azepine - Aralkylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Lactam - Secondary alcohol - Tertiary amine - 1,2-aminoalcohol - Azacycle - Ether - Carboxylic acid derivative - Primary amine - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Amine - Organic nitrogen compound - Alcohol - 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