Compound Identification
SMILES
COC1=C(OC)C=C2C(NC(=O)C3=NN(COC(=O)C4=CC=C(N)C=C4)N=C3C2=O)=C1
InChIKey
InChIKey=DWJDVAXJRGFQNG-UHFFFAOYSA-N
Formula
C20H17N5O6
Mass
423.385
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
Aminobenzoic acids and derivatives Benzoic acid esters Aniline and substituted anilines Anisoles Benzoyl derivatives Azepines Alkyl aryl ethers Heteroaromatic compounds Vinylogous amides Triazoles Carboxylic acid esters Amino acids and derivatives Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Aminobenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Anisole - Aniline or substituted anilines - Benzoyl - Phenol ether - Alkyl aryl ether - Azepine - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Vinylogous amide - 1,2,3-triazole - Carboxylic acid ester - Amino acid or derivatives - Lactam - Carboxylic acid derivative - Azacycle - Ether - Primary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - 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