Compound Identification
SMILES
CCOC(=O)CSCC1=C(C(C2=CC(=CC=C2)[N+]([O-])=O)C(=CN1)C(=O)OCC)C(=O)OCC
InChIKey
InChIKey=LNCNRGXTKMKULI-UHFFFAOYSA-N
Formula
C22H26N2O8S
Mass
478.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
-
Subclass
Hydropyridines
- Level 5 Dihydropyridines
-
Subclass
Hydropyridines
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Hydropyridines
Intermediate Tree Nodes
Dihydropyridines
Direct Parent
Dihydropyridinecarboxylic acids and derivatives
Alternative Parents
Tricarboxylic acids and derivatives Nitrobenzenes Nitroaromatic compounds Vinylogous amides Enoate esters Allylamines Azacyclic compounds Dialkylamines Dialkylthioethers Enamines Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Carbonyl compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Nitrobenzene - Tricarboxylic acid or derivatives - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Dialkylthioether - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Sulfenyl compound - Allylamine - Thioether - Secondary aliphatic amine - Enamine - Organic oxoazanium - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dihydropyridinecarboxylic acids and derivatives. These are compounds containing a dihydropyridine moiety bearing a carboxylic acid group.
External Descriptors
Not available