Compound Identification
SMILES
[Na+].CCC(C([O-])=O)C1=C(I)C(N2CCOCC2=O)=C(I)C=C1I
InChIKey
InChIKey=BNEAWBGCQLDUDT-UHFFFAOYSA-M
Formula
C14H13I3NNaO4
Mass
662.964
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Oxazinanes
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Subclass
Morpholines
- Level 5 Phenylmorpholines
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Subclass
Morpholines
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Class
Oxazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxazinanes
Subclass
Morpholines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmorpholines
Alternative Parents
Phenylpropanes Iodobenzenes Aryl iodides Tertiary carboxylic acid amides Lactams Carboxylic acid salts Oxacyclic compounds Organic metal halides Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylmorpholine - Phenylpropane - Iodobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl iodide - Aryl halide - Tertiary carboxylic acid amide - Lactam - Carboxylic acid salt - Carboxamide group - Organic metal halide - Oxacycle - Azacycle - Organic alkali metal salt - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmorpholines. These are aromatic compounds containing a morpholine ring and a benzene ring linked to each other through a CC or a CN bond.
External Descriptors
Not available