Compound Identification
SMILES
COC(=O)CC1=CC=C(NC(=O)NCC[C@@H]2[C@H](O[C@@H]3OC(C)(C)O[C@H]23)C(O)CO)C=C1
InChIKey
InChIKey=JJVVYQCFFLNMSP-XDYXMJOBSA-N
Formula
C21H30N2O8
Mass
438.477
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
Ketals Oxolanes Methyl esters 1,3-dioxolanes Ureas Secondary alcohols 1,2-diols Oxacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-phenylurea - Ketal - Meta-dioxolane - Oxolane - Methyl ester - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Urea - Acetal - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Primary alcohol - Alcohol - 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