Compound Identification
SMILES
CC1(C)CC(=O)C2=C(C1)O[C@H](C(C#N)C2=N)C1=CC=C(O)C=C1
InChIKey
InChIKey=RGYLQTMOFZHWBD-TYJDENFWSA-N
Formula
C18H18N2O3
Mass
310.353
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzopyrans
Alternative Parents
Cyclohexenones 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Vinylogous esters Ketimines Oxacyclic compounds Nitriles Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzopyran - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Cyclohexenone - Monocyclic benzene moiety - Benzenoid - Vinylogous ester - Ketimine - Ketone - Nitrile - Carbonitrile - Oxacycle - Organic oxide - Cyanide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aldehyde - Imine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzopyrans. These are organic compounds containing a benzene ring fused to a pyran ring. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds.
External Descriptors
Not available