Compound Identification
SMILES
[Cl-].COC(=O)C1=C(C)NC(C)=C(C#N)C1C1=C(OC(F)F)C=CC([NH3+])=C1
InChIKey
InChIKey=IUSLOSUMLQYKDD-UHFFFAOYSA-N
Formula
C17H18ClF2N3O3
Mass
385.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol ethers
Alternative Parents
Phenoxy compounds Aniline and substituted anilines Dihydropyridines Vinylogous amides Enoate esters Methyl esters Azacyclic compounds Dialkylamines Enamines Monocarboxylic acids and derivatives Nitriles Alkyl fluorides Organic zwitterions Organic oxides Hydrocarbon derivatives Organic chloride salts Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ether - Phenoxy compound - Aniline or substituted anilines - Dihydropyridine - Monocyclic benzene moiety - Hydropyridine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Secondary aliphatic amine - Organoheterocyclic compound - Enamine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Cyanide - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Organic salt - Alkyl fluoride - Organic oxygen compound - Organic chloride salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Alkyl halide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors
Not available