Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(CSCCCNC(N)=NCCCC2=CN=CN2)=C(C1C1=CC(=CC=C1)[N+]([O-])=O)C(=O)OCC
InChIKey
InChIKey=PXGGPYFXFBYUIE-UHFFFAOYSA-N
Formula
C29H39N7O6S
Mass
613.73
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
Nitrobenzenes Imidazolyl carboxylic acids and derivatives Nitroaromatic compounds Dicarboxylic acids and derivatives Vinylogous amides Enoate esters Heteroaromatic compounds Guanidines Azacyclic compounds Carboximidamides Dialkylamines Dialkylthioethers Sulfenyl compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Enamines Organic zwitterions Organic salts Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Dihydropyridinecarboxylic acid derivative - Nitroaromatic compound - Imidazolyl carboxylic acid derivative - Benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - C-nitro compound - Guanidine - Carboxylic acid ester - Organic nitro compound - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Enamine - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Thioether - Carboximidamide - Sulfenyl compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic zwitterion - 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