Compound Identification
SMILES
O=C(NC1=CC2=C(OCCO2)C=C1)C1=CC=C(S1)[C@@H]1CCC[NH2+]1
InChIKey
InChIKey=HBDUTSZQFJLTNZ-LBPRGKRZSA-O
Formula
C17H19N2O3S
Mass
331.41
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
Thiophene carboxamides 2-heteroaryl carboxamides 2,5-disubstituted thiophenes Alkyl aryl ethers Aralkylamines Para dioxins Benzenoids Quaternary ammonium salts Pyrrolidines Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - 2-heteroaryl carboxamide - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - Alkyl aryl ether - Aralkylamine - 2,5-disubstituted thiophene - Para-dioxin - Benzenoid - Heteroaromatic compound - Pyrrolidine - Quaternary ammonium salt - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Oxacycle - Azacycle - Organonitrogen compound - Amine - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic cation - 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