Compound Identification
SMILES
CN1C=NC=C1C(OCC1=C(C=C(C#N)C(=O)N1C)C1=CC2=C(OCO2)C=C1)C1=CC=C(C=C1)C#N
InChIKey
InChIKey=CRPNIZNJBGVBMQ-UHFFFAOYSA-N
Formula
C27H21N5O4
Mass
479.496
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Benzylethers 3-pyridinecarbonitriles Benzonitriles Pyridinones Dihydropyridines N-substituted imidazoles Heteroaromatic compounds Lactams Oxacyclic compounds Acetals Nitriles Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Benzylether - Benzonitrile - 3-pyridinecarbonitrile - Dihydropyridine - Pyridinone - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Pyridine - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Lactam - Acetal - Dialkyl ether - Ether - Oxacycle - Azacycle - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available