Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(=O)C1C(NC(=O)C1=O)C1=C[NH+]=CC=C1
InChIKey
InChIKey=ASUFDTBAMBMMKB-UHFFFAOYSA-O
Formula
C18H17N2O5
Mass
341.342
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
Pyrrolidinylpyridines Dimethoxybenzenes Anisoles Aryl alkyl ketones Benzoyl derivatives Phenoxy compounds Alkyl aryl ethers Beta-diketones Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridinium derivatives Heteroaromatic compounds Cyclic ketones Secondary carboxylic acid amides Lactams Azacyclic compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Pyrrolidinylpyridine - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Aryl alkyl ketone - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - 1,3-diketone - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyridine - Pyridinium - 1,3-dicarbonyl compound - Monocyclic benzene moiety - 3-pyrrolidone - Pyrrolidine - Heteroaromatic compound - Carboxamide group - Lactam - Cyclic ketone - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic cation - 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