Compound Identification
SMILES
OC1=C(Br)C=C(C=C1C=C1SC(NC2=CC=CC=C2)=NC1=O)[N+]([O-])=O
InChIKey
InChIKey=ANLDPMOFOZKRFM-UHFFFAOYSA-N
Formula
C16H10BrN3O4S
Mass
420.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
- Subclass Nitrophenols
-
Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Nitrophenols
Intermediate Tree Nodes
Not available
Direct Parent
Nitrophenols
Alternative Parents
Nitrobenzenes Aniline and substituted anilines O-bromophenols Nitroaromatic compounds Bromobenzenes Aryl bromides Thiazolines N-acylimines Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Organobromides Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrophenol - Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - 2-halophenol - 2-bromophenol - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Meta-thiazoline - Organic nitro compound - Isothiourea - C-nitro compound - N-acylimine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic zwitterion - Organohalogen compound - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrophenols. These are compounds containing a nitrophenol moiety, which consists of a benzene ring bearing both a hydroxyl group and a nitro group on two different ring carbon atoms.
External Descriptors
Not available