Compound Identification
SMILES
CCOC1=C(OCC2=CC(=CC=C2)[N+]([O-])=O)C(I)=CC(C=NNC(=O)C2=C(Cl)N=CC=C2)=C1
InChIKey
InChIKey=GRHPUABGCTVYJW-UHFFFAOYSA-N
Formula
C22H18ClIN4O5
Mass
580.76
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
-
Subclass
Pyridinecarboxylic acids and derivatives
-
Level 5
Pyridinecarboxamides
- Level 6 Nicotinamides
-
Level 5
Pyridinecarboxamides
-
Subclass
Pyridinecarboxylic acids and derivatives
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Pyridinecarboxamides
Direct Parent
Nicotinamides
Alternative Parents
Nitrobenzenes Phenoxy compounds Phenol ethers Nitroaromatic compounds 2-halopyridines Alkyl aryl ethers Iodobenzenes Aryl chlorides Aryl iodides Vinylogous halides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organic zwitterions Organochlorides Organoiodides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nicotinamide - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - 2-halopyridine - Iodobenzene - Halobenzene - Aryl chloride - Aryl halide - Benzenoid - Aryl iodide - Monocyclic benzene moiety - Vinylogous halide - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Ether - Azacycle - 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 - Organopnictogen compound - Organic oxygen compound - Organic zwitterion - Organohalogen compound - Organic nitrogen compound - Organochloride - Organoiodide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nicotinamides. These are heterocyclic aromatic compounds containing a pyridine ring substituted at position 3 by a carboxamide group.
External Descriptors
Not available