Compound Identification
SMILES
OC(=O)\C=C\C(O)=O.COC[C@@H]1[C@@H](CC2=C(C=CC(=C2)C(F)(F)F)N(CCN(C)C)C1=O)C1=CC=C(OC)C=C1
InChIKey
InChIKey=ZNXQQYFLPGHXIW-CDMZRFRJSA-N
Formula
C28H33F3N2O7
Mass
566.574
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
Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Azepines Unsaturated fatty acids Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Lactams Azacyclic compounds Dialkyl ethers Carboxylic acids Organofluorides Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Benzazepine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Azepine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Benzenoid - Fatty acid - Fatty acyl - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Lactam - Azacycle - Ether - Carboxylic acid derivative - Dialkyl ether - Carboxylic acid - Organic oxygen compound - Alkyl fluoride - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organonitrogen compound - Alkyl halide - Amine - Organooxygen 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