Compound Identification
SMILES
COC(=O)C1=C(C)NC(C)=C(C1C1=C(F)C(Cl)=CC=C1)C(=O)OCC(C)(C)CN(C)CC1=C(Cl)C=CC=C1Cl
InChIKey
InChIKey=TZKUWXPPCFSLFA-UHFFFAOYSA-N
Formula
C29H32Cl3FN2O4
Mass
597.93
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
Phenylmethylamines Benzylamines Dichlorobenzenes Aralkylamines Fluorobenzenes Aryl chlorides Aryl fluorides Dicarboxylic acids and derivatives Vinylogous amides Methyl esters Enoate esters Trialkylamines Amino acids and derivatives Azacyclic compounds Enamines Dialkylamines Organofluorides Hydrocarbon derivatives Organochlorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - 1,3-dichlorobenzene - Phenylmethylamine - Benzylamine - Fluorobenzene - Halobenzene - Chlorobenzene - Aralkylamine - Aryl halide - Aryl fluoride - Dicarboxylic acid or derivatives - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organofluoride - Organochloride - Organohalogen compound - Organic oxide - 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