Compound Identification
SMILES
CC1=CC(=CC(C)=C1NC(=O)N(CCCl)N=O)C(O)=O
InChIKey
InChIKey=JCVIOXBESVVEDT-UHFFFAOYSA-N
Formula
C12H14ClN3O4
Mass
299.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
-
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
Benzoic acids m-Xylenes Benzoyl derivatives Nitrosoureas Semicarbazides Nitrosamides Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
N-phenylurea - Benzoic acid - Benzoic acid or derivatives - M-xylene - Xylene - Benzoyl - Nitrosourea - Nitrosamide - Semicarbazide - Organic n-nitroso compound - Carbonic acid derivative - Organic nitroso compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Aromatic homomonocyclic 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