Compound Identification
SMILES
NC1=C(C#N)[C@H](C2=CN=CC=C2)C2=C(O1)C1=CC=CC=C1C(Cl)=C2
InChIKey
InChIKey=YXWBTLFGIQSVKA-QGZVFWFLSA-N
Formula
C19H12ClN3O
Mass
333.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Naphthopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Naphthopyrans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Naphthopyrans
Alternative Parents
Chloronaphthalenes 1-benzopyrans Pyridines and derivatives Pyrans Aryl chlorides Heteroaromatic compounds Ketene acetals Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Organochlorides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthopyran - Chloronaphthalene - Benzopyran - Naphthalene - 1-benzopyran - Aryl chloride - Aryl halide - Benzenoid - Pyridine - Pyran - Heteroaromatic compound - Ketene acetal or derivatives - Oxacycle - Azacycle - Carbonitrile - Nitrile - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthopyrans. These are compounds containing a pyran ring fused to a naphthalene moiety. Furan is a 6 membered-ring non-aromatic ring with five carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings.
External Descriptors
Not available