Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Hydropyridines

Intermediate Tree Nodes

Dihydropyridines

Direct Parent

Dihydropyridinecarboxylic acids and derivatives

Alternative Parents

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

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