Compound Identification
SMILES
CN(CCC1=CC=CC=C1)C(=O)[C@@H]1CC1C1=C(ON=C1C)C1=CC=C(Br)C=C1
InChIKey
InChIKey=DAGQIJIYPIJXCO-GFOWMXPYSA-N
Formula
C23H23BrN2O2
Mass
439.353
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Isoxazoles
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Level 5
Cyclopropylisoxazoles
- Level 6 4-cyclopropylisoxazoles
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Level 5
Cyclopropylisoxazoles
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Subclass
Isoxazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Isoxazoles
Intermediate Tree Nodes
Cyclopropylisoxazoles
Direct Parent
4-cyclopropylisoxazoles
Alternative Parents
Bromobenzenes Cyclopropanecarboxylic acids and derivatives Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-cyclopropylisoxazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Cyclopropanecarboxylic acid or derivatives - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4-cyclopropylisoxazoles. These are aromatic heterocyclic compounds containing an isoxazole ring substituted at the ring 4-position with a cyclopropyl group.
External Descriptors
Not available