Compound Identification
SMILES
CC(C)CC(=O)N(CC1=CC=C(Cl)C=C1)C1C=C(C2C(OC3=CC=CC=C23)C1O)C(=O)NCCO
InChIKey
InChIKey=LSERXQYVXCGLDL-UHFFFAOYSA-N
Formula
C27H31ClN2O5
Mass
499.0
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Coumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Coumarans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarans
Alternative Parents
N-acylethanolamines Chlorobenzenes Alkyl aryl ethers N-acyl amines Aryl chlorides Tertiary carboxylic acid amides Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Primary alcohols Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaran - N-acylethanolamine - Halobenzene - Alkyl aryl ether - Chlorobenzene - N-acyl-amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Alkanolamine - Oxacycle - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring.
External Descriptors
Not available