Compound Identification
SMILES
C\C(=N/NC(=O)CN1N=C(C)C(=C1C)[N+]([O-])=O)C1=CC=C(OC(=O)C2=CC=CO2)C=C1
InChIKey
InChIKey=NZYSAOIEUIBTBM-CIAFOILYSA-N
Formula
C20H19N5O6
Mass
425.401
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Furoic acid esters Phenoxy compounds Nitroaromatic compounds Pyrazoles Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organonitrogen compounds Organic zwitterions Organic oxides Carbonyl compounds Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ester - Furoic acid ester - Furoic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Monocyclic benzene moiety - Azole - Furan - Heteroaromatic compound - Pyrazole - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic zwitterion - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available