Compound Identification
SMILES
ClCC1=CC2=C(OC(=O)C(=C2)C(=O)NN2CCCCC2)C=C1
InChIKey
InChIKey=QQWIDZJYWDWHGH-UHFFFAOYSA-N
Formula
C16H17ClN2O3
Mass
320.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Pyranones and derivatives Piperidines Benzenoids Heteroaromatic compounds Carboxylic acid hydrazides Lactones Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds Alkyl chlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Pyranone - Piperidine - Pyran - Benzenoid - Heteroaromatic compound - Carboxylic acid hydrazide - Lactone - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organopnictogen compound - Alkyl chloride - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Alkyl halide - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available