Compound Identification
SMILES
COC1=CC2=C(C=C1)C1(NC(=O)NC1=O)N(C)C(=O)N2
InChIKey
InChIKey=WHZUDINITNVGFX-UHFFFAOYSA-N
Formula
C12H12N4O4
Mass
276.252
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azolidines
-
Subclass
Imidazolidines
-
Level 5
Imidazolidinones
-
Level 6
Imidazolidinediones
-
Level 7
Hydantoins
- Level 8 Allantoins
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Level 7
Hydantoins
-
Level 6
Imidazolidinediones
-
Level 5
Imidazolidinones
-
Subclass
Imidazolidines
-
Class
Azolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azolidines
Subclass
Imidazolidines
Intermediate Tree Nodes
Imidazolidinones - Imidazolidinediones - Hydantoins
Direct Parent
Allantoins
Alternative Parents
Quinazolines Alpha amino acids and derivatives Anisoles 5-monosubstituted hydantoins Pyrimidones N-acyl ureas Alkyl aryl ethers Dicarboximides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Allantoin - Diazanaphthalene - Alpha-amino acid or derivatives - Quinazoline - Anisole - 5-monosubstituted hydantoin - Alkyl aryl ether - N-acyl urea - Pyrimidone - Ureide - Pyrimidine - Benzenoid - Dicarboximide - Carbonic acid derivative - Urea - Azacycle - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as allantoins. These are heterocyclic compounds containing an imiazolidine ring substituted by a ketone group at positions 2 and 5, and an urea at position 4.
External Descriptors
Not available