Compound Identification
SMILES
COC1=C(OC)C=C(CCCN2CCC(CCC(=O)C3=CC(Cl)=C(N)C4=C3OCCO4)CC2)C=C1
InChIKey
InChIKey=UVOCSZKGWJOKNN-UHFFFAOYSA-N
Formula
C27H35ClN2O5
Mass
503.04
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
Phenylpropylamines Benzo-1,4-dioxanes Dimethoxybenzenes Anisoles Phenoxy compounds Aryl alkyl ketones Alkyl aryl ethers Aralkylamines Piperidines Para dioxins Aryl chlorides Trialkylamines Oxacyclic compounds Azacyclic compounds Primary amines Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Benzo-1,4-dioxane - Benzodioxane - O-dimethoxybenzene - Dimethoxybenzene - Phenylpropylamine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Aralkylamine - Aryl chloride - Aryl halide - Para-dioxin - Piperidine - Tertiary aliphatic amine - Tertiary amine - Ketone - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Primary amine - Organooxygen compound - 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