Compound Identification
SMILES
COCB(C(=O)N(C(C)=O)C(=O)C1=C(F)C=CC=C1F)C1=C(F)C=C(SC(F)(F)F)C=C1
InChIKey
InChIKey=NQCHPOHEUZFOGL-UHFFFAOYSA-N
Formula
C19H14BF6NO4S
Mass
477.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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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
2-halobenzoic acids and derivatives
Alternative Parents
Thiophenol ethers Benzoyl derivatives Alkylarylthioethers Fluorobenzenes Aryl fluorides N-substituted carboxylic acid imides Vinylogous halides Acetamides Dicarboximides Trihalomethanes Sulfenyl compounds Organic metalloid salts Dialkyl ethers Hydrocarbon derivatives Carbonyl compounds Monoalkylboranes Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
2-halobenzoic acid or derivatives - Aryl thioether - Benzoyl - Thiophenol ether - Fluorobenzene - Halobenzene - Alkylarylthioether - Aryl fluoride - Aryl halide - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Acetamide - Vinylogous halide - Trihalomethane - Carboxylic acid derivative - Dialkyl ether - Ether - Organic metalloid salt - Thioether - Sulfenyl compound - Monoalkylborane - Organic metalloid moeity - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Halomethane - Organic oxide - Alkyl halide - Alkylborane - Alkyl fluoride - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.
External Descriptors
Not available