Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(CSCC(O)CO)=C(C1C1=CC(=CC=C1)[N+]([O-])=O)C(=O)OCC
InChIKey
InChIKey=KURBOXAVRVSTMW-UHFFFAOYSA-N
Formula
C22H28N2O8S
Mass
480.53
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Hydropyridines
- Level 5 Dihydropyridines
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Subclass
Hydropyridines
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Class
Pyridines and derivatives
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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
Nitrobenzenes Nitroaromatic compounds Dicarboxylic acids and derivatives Enoate esters Vinylogous amides Secondary alcohols 1,2-diols Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkylamines Dialkylthioethers Enamines Sulfenyl compounds Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organic salts Primary alcohols Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - 1,2-diol - Carboxylic acid ester - C-nitro compound - Secondary alcohol - Organic nitro compound - Dialkylthioether - Azacycle - Organic 1,3-dipolar compound - Sulfenyl compound - Thioether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Organic oxoazanium - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Alcohol - Organosulfur compound - Carbonyl group - Organic salt - Primary alcohol - Organic zwitterion - 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