Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(NC(=O)N(CCN2CCOCC2)CC(=O)N(CC2=CC=CO2)CC2=CC3=C(OCO3)C=C2)C=C1
InChIKey
InChIKey=JXBJCSKLZWJRPL-UHFFFAOYSA-N
Formula
C28H31N5O8
Mass
565.583
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
Alpha amino acids and derivatives Benzodioxoles Nitrobenzenes Nitroaromatic compounds Morpholines Tertiary carboxylic acid amides Furans Heteroaromatic compounds Ureas Trialkylamines Acetals Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Dialkyl ethers Organic oxoazanium compounds Organopnictogen compounds Organic zwitterions Hydrocarbon derivatives Organic salts Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - N-phenylurea - Benzodioxole - Nitrobenzene - Nitroaromatic compound - Morpholine - Oxazinane - Furan - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - C-nitro compound - Tertiary amine - Organic nitro compound - Tertiary aliphatic amine - Urea - Organoheterocyclic compound - Organic 1,3-dipolar compound - Acetal - Azacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organic salt - 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