Compound Identification
SMILES
COC1=C(OCC2=CC=CC=C2)C=CC(=C1)C1C(C#N)=C(NC(C)=C1C(=O)OCC=C)SCC(=O)NC1=C(C)C=CC(C)=C1
InChIKey
InChIKey=XWOMXRZUEIPTSN-UHFFFAOYSA-N
Formula
C35H35N3O5S
Mass
609.74
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
Anilides p-Xylenes Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Alkyl aryl ethers Vinylogous amides Enoate esters Secondary carboxylic acid amides Ketene acetals Sulfenyl compounds Nitriles Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Anilide - Dihydropyridinecarboxylic acid derivative - Phenol ether - N-arylamide - Methoxybenzene - Phenoxy compound - Xylene - P-xylene - Anisole - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Ketene acetal or derivatives - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Carboxylic acid derivative - Azacycle - Ether - Sulfenyl compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxygen compound - Hydrocarbon derivative - Cyanide - Carbonyl group - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur 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