Compound Identification
SMILES
COC1=C(I)N=C(C=C1)C(O)=O
InChIKey
InChIKey=RAGBMWMAUGDAJG-UHFFFAOYSA-N
Formula
C7H6INO3
Mass
279.033
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Pyridinecarboxylic acids and derivatives
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Level 5
Pyridinecarboxylic acids
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Level 6
Pyridine-2-carboxylic acids
- Level 7 5-alkoxy-2-carboxypyrimidines
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Level 6
Pyridine-2-carboxylic acids
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Level 5
Pyridinecarboxylic acids
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Subclass
Pyridinecarboxylic acids and derivatives
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Pyridinecarboxylic acids - Pyridine-2-carboxylic acids
Direct Parent
5-alkoxy-2-carboxypyrimidines
Alternative Parents
Polyhalopyridines O-alkylpyrimidines Methylpyridines Hydroxypyridines Heterocyclic fatty acids Halogenated fatty acids Alkyl aryl ethers 2-halopyridines Secondary ketimines Heteroaromatic compounds Vinyl iodides Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Iodoalkenes Carboxylic acids Azacyclic compounds Organopnictogen compounds Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-alkoxy-2-carboxypyrimidine - O-alkylpyrimidine - Polyhalopyridine - 2-halopyridine - Methylpyridine - Hydroxypyridine - Heterocyclic fatty acid - Halogenated fatty acid - Alkyl aryl ether - Fatty acyl - Heteroaromatic compound - Secondary ketimine - Ketimine - Azacycle - Iodoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl iodide - Vinyl halide - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Imine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 5-alkoxy-2-carboxypyrimidines. These are pyrimidine-2-carboxylic acids that carry an alkoxy substituent at the 5-position of the pyridine ring.
External Descriptors
Not available