Compound Identification
SMILES
NC1=C(Cl)C=C(Cl)C=C1C(=O)OCC1=CC(=O)OC2=C1C1=CC=CC=C1C=C2
InChIKey
InChIKey=QPOJTHTXPYUZQO-UHFFFAOYSA-N
Formula
C21H13Cl2NO4
Mass
414.24
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
Coumarins and derivatives Benzoic acid esters Naphthalenes Aminobenzoic acids and derivatives 3-halobenzoic acids and derivatives 1-benzopyrans Benzoyl derivatives Aniline and substituted anilines Dichlorobenzenes Pyranones and derivatives Aryl chlorides Primary aromatic amines Heteroaromatic compounds Vinylogous amides Amino acids and derivatives Lactones Carboxylic acid esters Monocarboxylic acids and derivatives Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthopyran - Coumarin - Aminobenzoic acid or derivatives - Benzoate ester - Benzopyran - Naphthalene - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 1-benzopyran - Benzoic acid or derivatives - Benzoyl - 1,3-dichlorobenzene - Aniline or substituted anilines - Pyranone - Chlorobenzene - Halobenzene - Pyran - Primary aromatic amine - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Lactone - Amino acid or derivatives - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Primary amine - Hydrocarbon derivative - Amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen 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