Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)OC1CCN(CC1)C1=C(Cl)C=C(C=[NH+]1)C(F)(F)F
InChIKey
InChIKey=MDAXMXGTGSDSPX-UHFFFAOYSA-O
Formula
C19H19ClF3N2O3
Mass
415.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Methoxybenzoic acids and derivatives
Direct Parent
P-methoxybenzoic acids and derivatives
Alternative Parents
Benzoic acid esters Phenoxy compounds Anisoles Methoxybenzenes Dialkylarylamines Benzoyl derivatives Alkyl aryl ethers Aminopyridines and derivatives Pyridinium derivatives Piperidines Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organofluorides Organic oxides Organochlorides Alkyl fluorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - Benzoate ester - Phenoxy compound - Anisole - Phenol ether - Benzoyl - Methoxybenzene - Dialkylarylamine - Alkyl aryl ether - Aminopyridine - Aryl chloride - Piperidine - Aryl halide - Pyridinium - Pyridine - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Amine - Organooxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as p-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 4 of the benzene ring is replaced by a methoxy group.
External Descriptors
Not available