Compound Identification
SMILES
CC1=C([C@@H](C2=CC(Cl)=CC=C2)C(C(=O)OCCNC(=O)C2=CC=CC=C2C(O)=O)=C(C)N1)C(O)=O
InChIKey
InChIKey=CNBZZVCIZSBDBK-OAQYLSRUSA-N
Formula
C25H23ClN2O7
Mass
498.92
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
Benzamides Benzoic acids Benzoyl derivatives Chlorobenzenes Aryl chlorides Dicarboxylic acids and derivatives Vinylogous amides Enoate esters Secondary carboxylic acid amides Amino acids Azacyclic compounds Enamines Dialkylamines Carboxylic acids Organic oxides Organochlorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzamide - Benzoic acid or derivatives - Benzoic acid - Dihydropyridinecarboxylic acid derivative - Benzoyl - Chlorobenzene - Halobenzene - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Amino acid - Amino acid or derivatives - Secondary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Enamine - Secondary amine - Azacycle - Hydrocarbon derivative - Carbonyl group - Amine - Organic oxide - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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