Compound Identification
SMILES
COC(=O)CCCN(CCCNC(=O)NC1=CC=C(Br)C=C1)CC1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=BNGKTXHMTKMOHZ-UHFFFAOYSA-N
Formula
C23H28BrN3O5
Mass
506.397
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
Benzodioxoles Aralkylamines Fatty acid methyl esters Bromobenzenes Aryl bromides Methyl esters Ureas Trialkylamines Amino acids and derivatives Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Benzodioxole - Halobenzene - Aralkylamine - Fatty acid ester - Fatty acid methyl ester - Bromobenzene - Aryl bromide - Aryl halide - Fatty acyl - Methyl ester - Amino acid or derivatives - Urea - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Acetal - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available