Compound Identification
SMILES
C[NH+](C)[C@@H](CNC(=O)C1=C(C)OC(C)=C1)C1=CC=CC=C1Cl
InChIKey
InChIKey=LCTJNPKCLPCASD-INIZCTEOSA-O
Formula
C17H22ClN2O2
Mass
321.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furans
- Subclass Furoic acid and derivatives
-
Class
Furans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furans
Subclass
Furoic acid and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Furan-3-carboxylic acid and derivatives
Alternative Parents
Chlorobenzenes Aralkylamines Aryl chlorides Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Oxacyclic compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Furan-3-carboxylic acid or derivatives - Chlorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Quaternary ammonium salt - Carboxamide group - Tertiary aliphatic amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as furan-3-carboxylic acid and derivatives. These are aromatic heterocyclic compounds containing a furan ring, which carries a carboxyl group or a derivative thereof at the ring 3-position.
External Descriptors
Not available