Compound Identification
SMILES
OC[C@H]1COC2=C([C@H]1NC(=O)NC1=CC=C(Cl)C=C1)C1=CC=CC=C1C=C2
InChIKey
InChIKey=KFDSXHVZLNIECC-XOBRGWDASA-N
Formula
C21H19ClN2O3
Mass
382.84
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
1-benzopyrans N-phenylureas Naphthalenes Alkyl aryl ethers Chlorobenzenes Pyrans Aryl chlorides Ureas Oxacyclic compounds Organochlorides Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organopnictogen compounds Primary alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthopyran - Chromane - Benzopyran - N-phenylurea - Naphthalene - 1-benzopyran - Alkyl aryl ether - Chlorobenzene - Halobenzene - Benzenoid - Aryl halide - Pyran - Monocyclic benzene moiety - Aryl chloride - Urea - Oxacycle - Ether - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Alcohol - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen 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