Compound Identification
SMILES
COC1=C(OC(=O)C2=CC=CS2)C(Br)=CC(C=CC2=C(C(=O)NC(=O)N2)[N+]([O-])=O)=C1
InChIKey
InChIKey=MUNWYBURORLGPY-UHFFFAOYSA-N
Formula
C18H12BrN3O7S
Mass
494.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Anisoles Thiophene carboxylic acids and derivatives Styrenes Phenoxy compounds Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Pyrimidones Bromobenzenes Aryl bromides Hydropyrimidines Vinylogous amides Heteroaromatic compounds Lactams Ureas Carboxylic acid esters Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Organobromides Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ester - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - Styrene - Thiophene carboxylic acid or derivatives - Alkyl aryl ether - Bromobenzene - Halobenzene - Pyrimidone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Heteroaromatic compound - Thiophene - Vinylogous amide - Carboxylic acid ester - Lactam - C-nitro compound - Urea - Organic nitro compound - Organoheterocyclic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organic zwitterion - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available