Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)O\N=C/C1=C(SCC2=CC=C(C=C2)C(C)(C)C)N(C)N=C1C(F)(F)F
InChIKey
InChIKey=RRYWSZOUYSRHBO-NUJZUDFISA-N
Formula
C25H26F3N3O3S
Mass
505.56
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
Phenylpropanes Phenoxy compounds Anisoles Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Alkylarylthioethers Pyrazoles Oxime esters Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Carboxylic acids and derivatives Organic oxides Alkyl fluorides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-methoxybenzoic acid or derivatives - Phenylpropane - Phenoxy compound - Aryl thioether - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Azole - Heteroaromatic compound - Oximester - Pyrazole - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Alkyl halide - Organic oxygen compound - Organic oxide - 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