Compound Identification
SMILES
C[C@]12CC(C3=CC=CC=C3O1)C(C#N)=C(N)N2
InChIKey
InChIKey=MFJLVQPMXNDGLJ-WCRCJTMVSA-N
Formula
C13H13N3O
Mass
227.267
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
- Subclass 1-benzopyrans
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Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Tetrahydropyridines Benzenoids Ketene acetals Oxacyclic compounds Nitriles Dialkylamines Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - Tetrahydropyridine - Benzenoid - Ketene acetal or derivatives - Secondary aliphatic amine - Carbonitrile - Nitrile - Secondary amine - Azacycle - Oxacycle - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors
Not available