Compound Identification
SMILES
CC1=C([C@@H](C2=NC(=CC=C2)C(F)(F)F)C(=C(C)N1)[N+]([O-])=O)C(=O)OCCC1=CC=CC=C1
InChIKey
InChIKey=LVRJSIKXECNDIC-LJQANCHMSA-N
Formula
C22H20F3N3O4
Mass
447.414
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
Benzene and substituted derivatives Vinylogous amides Enoate esters Heteroaromatic compounds Amino acids and derivatives C-nitro compounds Monocarboxylic acids and derivatives Enamines Dialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Hydrocarbon derivatives Organic zwitterions Organofluorides Carbonyl compounds Alkyl fluorides Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Amino acid or derivatives - C-nitro compound - Carboxylic acid ester - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary aliphatic amine - Azacycle - Secondary amine - Enamine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxoazanium - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - 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