Trifluoromethanesulfonic acid 6-methanesulfonyloxy-1-[4-(2-piperidin-1-yl-ethoxy)-benzoyl]-naphthalen-2-yl ester

HCID 11628623

Basic information

Standard SMILES
CS(=O)(=O)Oc1ccc2c(C(=O)c3ccc(OCCN4CCCCC4)cc3)c(OS(=O)(=O)C(F)(F)F)ccc2c1
InChIKey
VQMNWBGJUGIMOP-UHFFFAOYSA-N
Molecular formula
C26H26F3NO8S2
Average molar mass
601.6 g/mol

Names & identifiers

Preferred name
Trifluoromethanesulfonic acid 6-methanesulfonyloxy-1-[4-(2-piperidin-1-yl-ethoxy)-benzoyl]-naphthalen-2-yl ester
IUPAC
[6-methylsulfonyloxy-1-[4-(2-piperidin-1-ylethoxy)benzoyl]naphthalen-2-yl] trifluoromethanesulfonate

Names & synonyms

Trifluoromethanesulfonic acid 6-methanesulfonyloxy-1-[4-(2-piperidin-1-yl-ethoxy)-benzoyl]-naphthalen-2-yl esterSCHEMBL1358542Trifluoro-methanesulfonic acid 6-methanesulfonyloxy-1-[4-(2-piperidin-1-yl-ethoxy)-benzoyl]-naphthalen-2-yl ester

Database identifiers

PubChem CID
11628623

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
133 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
12
Rotatable bonds
10
Heavy atoms
40

Related reactions

10 records

Compound notes

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