3-(5-Chloro-2-methoxy-benzenesulfonylamino)-4-hydroxy-5-trifluoromethyl-benzoic acid methyl ester

HCID 66788674
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)c1cc(NS(=O)(=O)c2cc(Cl)ccc2OC)c(O)c(C(F)(F)F)c1
InChIKey
OIQXVMOZJKFJLR-UHFFFAOYSA-N
Molecular formula
C16H13ClF3NO6S
Average molar mass
439.8 g/mol

Names & identifiers

Preferred name
3-(5-Chloro-2-methoxy-benzenesulfonylamino)-4-hydroxy-5-trifluoromethyl-benzoic acid methyl ester
IUPAC
methyl 3-[(5-chloro-2-methoxyphenyl)sulfonylamino]-4-hydroxy-5-(trifluoromethyl)benzoate

Names & synonyms

3-(5-chloro-2-methoxy-benzenesulfonylamino)-4-hydroxy-5-trifluoromethyl-benzoic acid methyl esterSCHEMBL750909

Database identifiers

PubChem CID
66788674

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
110 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
6
Heavy atoms
28

Related reactions

7 records
New reaction record

Compound notes

Loading…