Compound Identification
SMILES
CCOC(=O)C1=C(C(Br)=C2C=CC=CN12)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=CBJAFHLZKHKWRL-UHFFFAOYSA-N
Formula
C17H13BrN2O4
Mass
389.205
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Indolizines Nitrobenzenes Pyrrole carboxylic acids and derivatives Nitroaromatic compounds Pyridines and derivatives Aryl bromides Heteroaromatic compounds Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic salts Organobromides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrole - Indolizine - Nitrobenzene - Pyrrolopyridine - Nitroaromatic compound - Pyrrole-2-carboxylic acid or derivatives - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Pyridine - Heteroaromatic compound - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Hydrocarbon derivative - Organic salt - Organobromide - Organohalogen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available