Compound Identification
SMILES
C[C@H](C1CC1)N1C=C(Cl)N=C(NC2=C(Cl)C=C3COCC3=C2)C1=O
InChIKey
InChIKey=ISTVOPWEEMUDPG-SECBINFHSA-N
Formula
C17H17Cl2N3O2
Mass
366.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Isocoumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isocoumarans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isocoumarans
Alternative Parents
Aminopyrazines Imidolactams Benzenoids Aryl chlorides Heteroaromatic compounds Lactams Secondary amines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isocoumaran - Aminopyrazine - Aryl chloride - Aryl halide - Pyrazine - Benzenoid - Imidolactam - Heteroaromatic compound - Lactam - Oxacycle - Secondary amine - Ether - Dialkyl ether - Azacycle - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isocoumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 1,3-dihydrofuran ring.
External Descriptors
Not available