Compound Identification
SMILES
CN(CC1CC(C1)OC1=CC(Cl)=C(CN2CCCC2)C=C1)C(=O)C1=CC(F)=C(F)C=C1
InChIKey
InChIKey=FLOVQSFWCSSDTR-UHFFFAOYSA-N
Formula
C24H27ClF2N2O2
Mass
448.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Halobenzoic acids and derivatives
Direct Parent
4-halobenzoic acids and derivatives
Alternative Parents
3-halobenzoic acids and derivatives Benzamides Phenylmethylamines Phenoxy compounds Phenol ethers Benzoyl derivatives Benzylamines Alkyl aryl ethers Aralkylamines Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides N-alkylpyrrolidines Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Organochlorides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzamide - Benzoyl - Benzylamine - Phenol ether - Phenylmethylamine - Phenoxy compound - Chlorobenzene - Fluorobenzene - Halobenzene - Aralkylamine - Alkyl aryl ether - N-alkylpyrrolidine - Aryl chloride - Aryl halide - Aryl fluoride - Tertiary carboxylic acid amide - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Amino acid or derivatives - Azacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxide - Organohalogen compound - Amine - Organochloride - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
External Descriptors
Not available