Compound Identification
SMILES
CCOC(NC1=CC=C(SC)C=C1)C(=O)C1=CC(=C(Cl)C=C1)[N+]([O-])=O
InChIKey
InChIKey=FALVILQYMRNRNL-UHFFFAOYSA-N
Formula
C17H17ClN2O4S
Mass
380.84
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
Nitrobenzenes Thiophenol ethers Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Phenylalkylamines Alkylarylthioethers Secondary alkylarylamines Chlorobenzenes Aryl chlorides Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Organic oxoazanium compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organic zwitterions Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Nitrobenzene - Benzoyl - Thiophenol ether - Aryl alkyl ketone - Phenylalkylamine - Aryl thioether - Nitroaromatic compound - Chlorobenzene - Alkylarylthioether - Halobenzene - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxoazanium - Organic 1,3-dipolar compound - Secondary amine - Thioether - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organic zwitterion - Organochloride - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Amine - Organopnictogen compound - Aromatic homomonocyclic 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