Compound Identification
SMILES
O=S(=O)(N1CC(C1)N1CCN(CC1)C1CCCCC1)C1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=ILDLBCIIRCXVTN-UHFFFAOYSA-N
Formula
C21H31N3O4S
Mass
421.56
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
N-alkylpiperazines Cyclohexylamines Alkyl aryl ethers Para dioxins Organosulfonamides Benzenoids Sulfonyls Trialkylamines Azetidines Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - N-alkylpiperazine - Cyclohexylamine - Alkyl aryl ether - Benzenoid - Organosulfonic acid amide - Piperazine - Para-dioxin - 1,4-diazinane - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Azetidine - Oxacycle - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - 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