Compound Identification
SMILES
O.OC(=O)C(O)=O.ClC1=CC2=C(C=C1)C1CN(CC3=CC=CC=C3)CC2O1
InChIKey
InChIKey=MOOAAJBLIUQFTQ-UHFFFAOYSA-N
Formula
C19H20ClNO6
Mass
393.82
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
Isocoumarans Phenylmethylamines Benzylamines Aralkylamines Azepines Aryl chlorides Dicarboxylic acids and derivatives Morpholines Trialkylamines Dialkyl ethers Carboxylic acids Oxacyclic compounds Azacyclic compounds Carbonyl compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
Benzazepine - Isocoumaran - Phenylmethylamine - Benzylamine - Azepine - Aralkylamine - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Morpholine - Benzenoid - Oxazinane - Monocyclic benzene moiety - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Ether - Oxacycle - Dialkyl ether - Amine - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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