Compound Identification
SMILES
[O-][N+](=O)C1=CC2=C(OCCO2)C=C1NC(=O)C(=CC1=C(N=C(S1)N1CCOCC1)C1=CC=CC=C1)C#N
InChIKey
InChIKey=LENQPIHJQZPLTD-UHFFFAOYSA-N
Formula
C25H21N5O6S
Mass
519.53
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodioxanes
- Subclass Benzo-1,4-dioxanes
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Class
Benzodioxanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,4-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,4-dioxanes
Alternative Parents
Dialkylarylamines N-arylamides Nitroaromatic compounds 2,4,5-trisubstituted thiazoles Alkyl aryl ethers 2-amino-1,3-thiazoles Benzene and substituted derivatives Morpholines Para dioxins Heteroaromatic compounds Secondary carboxylic acid amides Organic oxoazanium compounds Nitriles Dialkyl ethers Azacyclic compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - 2,4,5-trisubstituted 1,3-thiazole - Nitroaromatic compound - Dialkylarylamine - N-arylamide - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Oxazinane - Para-dioxin - 1,3-thiazol-2-amine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Carbonitrile - Nitrile - Organic oxoazanium - Azacycle - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Cyanide - Amine - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.
External Descriptors
Not available