Compound Identification
SMILES
COC1=C(OCC2=C(C)OC(=N2)C2=CC=CO2)C=CC(CCC[C@H]2OC(=O)NC2=O)=C1
InChIKey
InChIKey=MWAWVTYQASXVJZ-QGZVFWFLSA-N
Formula
C22H22N2O7
Mass
426.425
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Oxazoles
- Level 5 2,4,5-trisubstituted oxazoles
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Subclass
Oxazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxazoles
Intermediate Tree Nodes
Not available
Direct Parent
2,4,5-trisubstituted oxazoles
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Oxazolidinediones Alkyl aryl ethers Heteroaromatic compounds Furans Dicarboximides Carbamate esters Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2,4,5-trisubstituted 1,3-oxazole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Oxazolidinedione - Monocyclic benzene moiety - Benzenoid - Oxazolidinone - Heteroaromatic compound - Dicarboximide - Furan - Carbamic acid ester - Oxazolidine - Carboxylic acid derivative - Oxacycle - Ether - Azacycle - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2,4,5-trisubstituted oxazoles. These are compounds containing an oxazole ring substituted at positions 2, 4 and 5 only. Oxazole is a five-membered aromatic heterocycle with one oxygen, one nitrogen, and three carbon atoms. Isomers include 1,2-oxazole and 1,3-oxazole.
External Descriptors
Not available