Compound Identification
SMILES
CC1=CSC(=N1)N1C(C2=C(OC3=C(C=C(Cl)C=C3)C2=O)C1=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=HUKORXNWGDLELI-UHFFFAOYSA-N
Formula
C21H12ClN3O5S
Mass
453.85
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
-
Subclass
1-benzopyrans
- Level 5 Chromones
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Subclass
1-benzopyrans
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Class
Benzopyrans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
Chromones
Alternative Parents
Nitrobenzenes 2-heteroaryl carboxamides Nitroaromatic compounds Pyranones and derivatives 2,4-disubstituted thiazoles Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions Organochlorides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chromone - Nitrobenzene - 2-heteroaryl carboxamide - Nitroaromatic compound - 2,4-disubstituted 1,3-thiazole - Pyranone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - Lactam - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Organic oxoazanium - Carboxylic acid derivative - Azacycle - Organic zwitterion - Organic oxygen compound - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.
External Descriptors
Not available