Compound Identification
SMILES
C[C@H](CC1=CC2=C(OC(O2)(C(=O)OCCC2=CC=CS2)C(=O)OCCC2=CC=CS2)C=C1)NC[C@H](O)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=KSZWYINMRMPIJQ-ZBLYBZFDSA-N
Formula
C32H32ClNO7S2
Mass
642.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Aralkylamines Chlorobenzenes Ketals Aryl chlorides Dicarboxylic acids and derivatives Heteroaromatic compounds Thiophenes Amino acids and derivatives Secondary alcohols Carboxylic acid esters 1,2-aminoalcohols Oxacyclic compounds Dialkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Chlorobenzene - Halobenzene - Ketal - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Heteroaromatic compound - Thiophene - Amino acid or derivatives - 1,2-aminoalcohol - Carboxylic acid ester - Secondary alcohol - Secondary amine - Acetal - Carboxylic acid derivative - Oxacycle - Secondary aliphatic amine - Organochloride - Organic oxygen compound - Amine - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Alcohol - Organohalogen compound - Aromatic alcohol - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available