Compound Identification
SMILES
CC1=CC=C(O1)C(=O)\C=C\C1=CC=C(C=C1)C(=O)C(NCCOCCOCCN)C1=C2C=CC(Cl)=CC2=NC=C1
InChIKey
InChIKey=VDBNJAAEVWRPFS-BJMVGYQFSA-N
Formula
C31H32ClN3O5
Mass
562.06
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
Cinnamic acids and derivatives Chloroquinolines Styrenes Aryl alkyl ketones Benzoyl derivatives Aralkylamines Pyridines and derivatives Aryl chlorides Acryloyl compounds Alpha-amino ketones Heteroaromatic compounds Furans Enones Oxacyclic compounds Azacyclic compounds Dialkylamines Dialkyl ethers Hydrocarbon derivatives Organochlorides Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Cinnamic acid or derivatives - Haloquinoline - Chloroquinoline - Quinoline - Styrene - Aryl alkyl ketone - Benzoyl - Aralkylamine - Aryl halide - Benzenoid - Aryl chloride - Pyridine - Monocyclic benzene moiety - Furan - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Alpha-aminoketone - Acryloyl-group - Enone - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Dialkyl ether - Secondary aliphatic amine - Ether - Hydrocarbon derivative - Amine - Organic nitrogen compound - Primary amine - Organic oxide - Organonitrogen compound - Primary aliphatic amine - Organohalogen compound - Organochloride - Aromatic heteropolycyclic 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