Compound Identification
SMILES
CN(C1=CC=CC=C1)C1=C(Cl)C(=O)OC2=C1CCC1=C2C=CO1
InChIKey
InChIKey=PEXIVNHABFJQOO-UHFFFAOYSA-N
Formula
C18H14ClNO3
Mass
327.76
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
- Subclass Furanocoumarins
-
Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Furanocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Furanocoumarins
Alternative Parents
Alkyldiarylamines Aniline and substituted anilines Pyranones and derivatives Aryl chlorides Vinylogous amides Heteroaromatic compounds Furans Lactones Oxacyclic compounds Organopnictogen compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Furanocoumarin - Alkyldiarylamine - Aniline or substituted anilines - Tertiary aliphatic/aromatic amine - Pyranone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Benzenoid - Furan - Heteroaromatic compound - Vinylogous amide - Lactone - Tertiary amine - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as furanocoumarins. These are polycyclic aromatic compounds containing a furan ring fused to a coumarin moiety.
External Descriptors
Not available