Compound Identification
SMILES
[O-]S(=O)(=O)C(F)(F)F.CCOC(=O)C\C=C\[C@H]1C[C@H]2CC[C@H](CCC3=CC=CC=C3)[N+]2=C(N)N1
InChIKey
InChIKey=NSKDHGHIBJZLIG-QDVWVABXSA-N
Formula
C22H30F3N3O5S
Mass
505.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic sulfonic acids and derivatives
-
Subclass
Organosulfonic acids and derivatives
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Level 5
Alkanesulfonic acids and derivatives
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Level 6
Alkanesulfonic acids
- Level 7 Trifluoromethanesulfonates
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Level 6
Alkanesulfonic acids
-
Level 5
Alkanesulfonic acids and derivatives
-
Subclass
Organosulfonic acids and derivatives
-
Class
Organic sulfonic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic sulfonic acids and derivatives
Subclass
Organosulfonic acids and derivatives
Intermediate Tree Nodes
Alkanesulfonic acids and derivatives - Alkanesulfonic acids
Direct Parent
Trifluoromethanesulfonates
Alternative Parents
Fatty acid esters Benzene and substituted derivatives Hydropyrimidines Sulfonyls Pyrrolidines Organosulfonic acids Methanesulfonates Trihalomethanes Carboxylic acid esters Guanidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboximidamides Monocarboxylic acids and derivatives Organofluorides Alkyl fluorides Carbonyl compounds Organic oxides Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Not available
Substituents
Trifluoromethanesulfonate - Fatty acid ester - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Fatty acyl - Benzenoid - Methanesulfonate - Pyrrolidine - Organosulfonic acid - Sulfonyl - Carboxylic acid ester - Trihalomethane - Guanidine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Hydrocarbon derivative - Halomethane - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Alkyl fluoride - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethanesulfonates. These are alkanesulfonic acids, that contain a sulfonate group that is substituted with a trifluoromethyl group.
External Descriptors
Not available