Compound Identification
SMILES
O=C(NC1=CN(CCOCC2=CC=CC=C2)N=C1)C1=COC2=C1C(=O)CCC2
InChIKey
InChIKey=ZXBAZOCZHTUYGI-UHFFFAOYSA-N
Formula
C21H21N3O4
Mass
379.416
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzofurans
Alternative Parents
Benzylethers Furan-3-carboxylic acid and derivatives Aryl alkyl ketones Pyrazoles Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - Benzylether - Furoic acid or derivatives - Furan-3-carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Pyrazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Ketone - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aldehyde - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.
External Descriptors
Not available