Compound Identification
SMILES
COC(=O)C1=CC=C(CN2C(=O)NC(=CC3=CC(=C(O)C=C3)[N+]([O-])=O)C2=O)O1
InChIKey
InChIKey=UOOPZRUNUMOORT-UHFFFAOYSA-N
Formula
C17H13N3O8
Mass
387.304
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azolidines
-
Subclass
Imidazolidines
-
Level 5
Imidazolidinones
-
Level 6
Imidazolidinediones
- 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
Direct Parent
Hydantoins
Alternative Parents
Alpha amino acids and derivatives Nitrophenols Furoic acid esters Nitrobenzenes Nitroaromatic compounds 1-hydroxy-2-unsubstituted benzenoids N-acyl ureas Methyl esters Heteroaromatic compounds Dicarboximides Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydantoin - Alpha-amino acid or derivatives - Nitrophenol - Furoic acid ester - Nitrobenzene - Furoic acid or derivatives - Nitroaromatic compound - 1-hydroxy-2-unsubstituted benzenoid - N-acyl urea - Phenol - Ureide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Dicarboximide - Furan - Methyl ester - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Carbonic acid derivative - Urea - Oxacycle - Carboxylic acid derivative - Azacycle - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydantoins. These are heterocyclic compounds containing an imidazolidine substituted by ketone group at positions 2 and 4.
External Descriptors
Not available