Compound Identification
SMILES
COC1=C2OC(C)=CC2=C(C=C1)C(=O)CCC(O)=O
InChIKey
InChIKey=LBRJCNYBXRTXAA-UHFFFAOYSA-N
Formula
C14H14O5
Mass
262.261
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Benzofurans Gamma-keto acids and derivatives Aryl alkyl ketones Anisoles Alkyl aryl ethers Heteroaromatic compounds Furans Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Benzofuran - Anisole - Gamma-keto acid - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Keto acid - Furan - Heteroaromatic compound - Ketone - Monocarboxylic acid or derivatives - Oxacycle - Ether - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available