Compound Identification
SMILES
COC1=CC=CC=C1SCC1CC(OC(O1)C1=CC=C(CNC(=O)C2=C(F)C(F)=C(F)C(F)=C2F)C=C1)C1=CC=C(CO)C=C1
InChIKey
InChIKey=AQRJVEJENJVHKW-UHFFFAOYSA-N
Formula
C33H28F5NO5S
Mass
645.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzamides
- Level 6 N-benzylbenzamides
-
Level 5
Benzamides
-
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
Benzamides
Direct Parent
N-benzylbenzamides
Alternative Parents
2-halobenzoic acids and derivatives 3-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Thiophenol ethers Phenoxy compounds Anisoles Methoxybenzenes Benzyl alcohols Benzoyl derivatives Alkyl aryl ethers Alkylarylthioethers Fluorobenzenes 1,3-dioxanes Aryl fluorides Vinylogous halides Secondary carboxylic acid amides Sulfenyl compounds Oxacyclic compounds Acetals Organofluorides Organonitrogen compounds Primary alcohols Organopnictogen compounds Organic oxides Aromatic alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-benzylbenzamide - 3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Thiophenol ether - Benzoyl - Methoxybenzene - Benzyl alcohol - Alkylarylthioether - Fluorobenzene - Halobenzene - Alkyl aryl ether - Meta-dioxane - Aryl halide - Aryl fluoride - Vinylogous halide - Carboxamide group - Secondary carboxylic acid amide - Thioether - Acetal - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Sulfenyl compound - Organosulfur compound - Aromatic alcohol - Organohalogen compound - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Alcohol - Primary alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.
External Descriptors
Not available