Compound Identification
SMILES
CC(C)C1=CC(=CC(C(C)C)=C1OS(=O)(=O)C1=C(O)C=C(C=C1)C(O)=O)C(=O)C1=C(CC2=CC=C(Br)C=C2)OC(C)=C1C
InChIKey
InChIKey=ZMSIOXGUTRWOPY-UHFFFAOYSA-N
Formula
C33H33BrO8S
Mass
669.58
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
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Level 5
Ketones
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Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Aryl-phenylketones
Alternative Parents
Benzenesulfonate esters Hydroxybenzoic acid derivatives Arylsulfonic acids and derivatives Benzenesulfonyl compounds Benzoic acids Cumenes Phenylpropanes Benzoyl derivatives 3-aroylfurans Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoids Bromobenzenes 1-hydroxy-4-unsubstituted benzenoids Aryl bromides Organosulfonic acid esters Heteroaromatic compounds Sulfonyls Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Benzenesulfonate ester - Hydroxybenzoic acid - Benzenesulfonate - Cumene - Benzoic acid - Benzoic acid or derivatives - Phenylpropane - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 3-aroylfuran - Benzoyl - Phenoxy compound - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Phenol - Bromobenzene - Monocyclic benzene moiety - Benzenoid - Aryl bromide - Organosulfonic acid ester - Aryl halide - Heteroaromatic compound - Furan - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Oxacycle - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Organosulfur compound - Organic oxide - Organobromide - Organohalogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available