Compound Identification
SMILES
CC(C)(C)[C@@](O)(CCN(CC1=CN=C(Cl)C=C1)C(O)=O)[C@@H]1OC(=O)C=C1N1CCCC1
InChIKey
InChIKey=GSXYGDXYSHNBEP-DENIHFKCSA-N
Formula
C22H30ClN3O5
Mass
451.95
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
Halopyridines
- Level 5 2-halopyridines
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Subclass
Halopyridines
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Halopyridines
Intermediate Tree Nodes
Not available
Direct Parent
2-halopyridines
Alternative Parents
Aryl chlorides Butenolides Vinylogous amides Tertiary alcohols Pyrrolidines 1,3-aminoalcohols Heteroaromatic compounds Enoate esters Trialkylamines Lactones Carbamic acids Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Enamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-halopyridine - Aryl chloride - Aryl halide - 2-furanone - 1,3-aminoalcohol - Heteroaromatic compound - Dihydrofuran - Pyrrolidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tertiary alcohol - Amino acid or derivatives - Carbamic acid - Carbamic acid derivative - Carboxylic acid ester - Lactone - Tertiary aliphatic amine - Tertiary amine - Monocarboxylic acid or derivatives - Azacycle - Enamine - Oxacycle - Carboxylic acid derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Amine - Alcohol - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-halopyridines. These are organic compounds containing a pyridine ring substituted at the 2-position by a halogen atom.
External Descriptors
Not available