Compound Identification
SMILES
CN1CCC2=C(Cl)C=CC3=C2C(C1)=C(O3)\C=C(/C([O-])=O)C1=CC=CC=C1
InChIKey
InChIKey=DIEWFLAEPDZWAQ-PTNGSMBKSA-M
Formula
C21H17ClNO3
Mass
366.82
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
Benzofurans Styrenes Aralkylamines Azepines Aryl chlorides Furans Heteroaromatic compounds Trialkylamines Amino acids Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organochlorides Organopnictogen compounds Organic oxides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Benzofuran - Styrene - Azepine - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Furan - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organopnictogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organic anion - 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