Compound Identification
SMILES
[Ca++].[O-]C1=NOCC1N=CC1=CC=C(O1)C=NC1CON=C1[O-]
InChIKey
InChIKey=UDMLCPWBWKPKSO-UHFFFAOYSA-L
Formula
C12H10CaN4O5
Mass
330.313
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azolines
- Subclass Isoxazolines
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Class
Azolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azolines
Subclass
Isoxazolines
Intermediate Tree Nodes
Not available
Direct Parent
Isoxazolines
Alternative Parents
Heteroaromatic compounds Furans Shiff bases Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic calcium salts Azacyclic compounds Organooxygen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Furan - Isoxazoline - Heteroaromatic compound - Shiff base - Aldimine - Organic calcium salt - Oxacycle - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organic salt - Organic zwitterion - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Imine - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as isoxazolines. These are compounds containing a five-member unsaturated aliphatic ring, with an oxygen atom adjacent to a nitrogen atoms, and three carbon atoms.
External Descriptors
Not available