Compound Identification
SMILES
COC1=C(COC2=C(C=C(C=C2)S(=O)(=O)N2CCCC2)[N+]([O-])=O)C=C(C=C1)C(C)=O
InChIKey
InChIKey=JZVRRMDGDQIQIL-UHFFFAOYSA-N
Formula
C20H22N2O7S
Mass
434.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-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
Alkyl-phenylketones
Alternative Parents
Nitrophenyl ethers Benzenesulfonamides Acetophenones Benzenesulfonyl compounds Anisoles Aryl alkyl ketones Phenoxy compounds Benzoyl derivatives Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Organosulfonamides Sulfonyls Pyrrolidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Nitrophenyl ether - Benzenesulfonamide - Acetophenone - Nitrobenzene - Benzenesulfonyl group - Phenol ether - Aryl alkyl ketone - Phenoxy compound - Benzoyl - Methoxybenzene - Nitroaromatic compound - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Ether - Organoheterocyclic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Organosulfur compound - Organonitrogen compound - Organic salt - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available