Compound Identification
SMILES
CCOC(=O)C(C(=O)OCC)=C1OC2=CC=CC=C2N1CCCCOC(=O)C=C
InChIKey
InChIKey=OITDCABIRMQTDZ-UHFFFAOYSA-N
Formula
C21H25NO7
Mass
403.431
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazolines
Alternative Parents
Tricarboxylic acids and derivatives Benzenoids Acrylic acid esters Vinylogous esters Vinylogous amides Enoate esters Tertiary amines Ketene acetals Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazoline - Tricarboxylic acid or derivatives - Acrylic acid ester - Benzenoid - Acrylic acid or derivatives - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Vinylogous ester - Amino acid or derivatives - Carboxylic acid ester - Ketene acetal or derivatives - Tertiary amine - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazolines. These are organic compounds containing a benzene ring fused to an oxazoline ring. Oxazoline is five-membered unsaturated ring with a nitrogen atom and an oxygen atom at the 1- and 3-position, respectively. Additionally, it contains two double bonds.
External Descriptors
Not available