Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC=C1S(=O)(=O)C(F)(F)F)C(=O)OCC
InChIKey
InChIKey=XDSWZCXHAKXFND-UHFFFAOYSA-N
Formula
C20H22F3NO6S
Mass
461.45
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
Benzenesulfonyl compounds Dicarboxylic acids and derivatives Vinylogous amides Sulfones Enoate esters Trihalomethanes Enamines Dialkylamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Benzenesulfonyl group - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Sulfone - Sulfonyl - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - Trihalomethane - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Halomethane - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organosulfur compound - Alkyl fluoride - Alkyl halide - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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