Compound Identification
SMILES
CC1=CC=C(CN(CC2=CC=C(F)C=C2)C(=O)CN(CCN2CCOCC2)C(=O)NC2=CC=C(C=C2)[N+]([O-])=O)O1
InChIKey
InChIKey=HSPKFMINKATGNX-UHFFFAOYSA-N
Formula
C28H32FN5O6
Mass
553.591
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 Nitrobenzenes Nitroaromatic compounds Fluorobenzenes Aryl fluorides Morpholines Furans Heteroaromatic compounds Tertiary carboxylic acid amides Ureas Trialkylamines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxoazanium compounds Organofluorides Organic zwitterions Organic salts Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - N-phenylurea - Nitrobenzene - Nitroaromatic compound - Halobenzene - Fluorobenzene - Oxazinane - Aryl fluoride - Morpholine - Aryl halide - Tertiary carboxylic acid amide - Furan - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - C-nitro compound - Amino acid or derivatives - Urea - Organic nitro compound - Carboxamide group - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxide - Organic salt - Carbonyl group - Organic nitrogen compound - Amine - Organic zwitterion - Organohalogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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