Compound Identification
SMILES
CO\N=C1\C[C@H]2OC3=C4C(CN(CCCSC)[C@H](CO)CC24C=C1)=CC(OCC1=CC(=CC=C1)[N+]([O-])=O)=C3Br
InChIKey
InChIKey=AICWUWOYGIMJGB-BOQJHKDQSA-N
Formula
C28H32BrN3O6S
Mass
618.54
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
Coumarans Nitrobenzenes Phenol ethers Nitroaromatic compounds Alkyl aryl ethers Aralkylamines Azepines Aryl bromides Trialkylamines 1,2-aminoalcohols Oxime ethers Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkylthioethers Organic oxoazanium compounds Organic zwitterions Primary alcohols Hydrocarbon derivatives Organic salts Organobromides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Coumaran - Nitrobenzene - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Azepine - Aralkylamine - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - C-nitro compound - Oxime ether - Organic nitro compound - 1,2-aminoalcohol - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Ether - Dialkylthioether - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organic oxide - Organohalogen compound - Amine - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Primary alcohol - Organic zwitterion - Alcohol - Organic salt - 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