Compound Identification
SMILES
CCC1=NC(CC)=C(C(C2=CC(=CC=C2)[N+]([O-])=O)\C1=C1/ONC(CSCC2=CC=CC=C2)=N1)C(=O)OC
InChIKey
InChIKey=GSKXTTYEYSBTBL-LCUIJRPUSA-N
Formula
C27H28N4O5S
Mass
520.6
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 Imidolactams Methyl esters Enoate esters Ketimines Ketene acetals Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Amidines Azacyclic compounds Organic oxoazanium compounds Dialkylthioethers Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Imidolactam - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Ketene acetal or derivatives - Ketimine - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Azacycle - Oxacycle - Dialkylthioether - Organic 1,3-dipolar compound - Sulfenyl compound - Thioether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Amidine - Organic oxoazanium - Monocarboxylic acid or derivatives - Organic salt - Carbonyl group - Organic oxide - Organic nitrogen compound - Imine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - 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