3-(4-chlorophenoxy)-2-methyl-5-(methylsulfonyl)-1H-indole-1-acetic acid, methyl ester

HCID 86609234
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)Cn1c(C)c(Oc2ccc(Cl)cc2)c2cc(S(C)(=O)=O)ccc21
InChIKey
INPDHLQEKDPTJM-UHFFFAOYSA-N
Molecular formula
C19H18ClNO5S
Average molar mass
407.9 g/mol

Names & identifiers

Preferred name
3-(4-chlorophenoxy)-2-methyl-5-(methylsulfonyl)-1H-indole-1-acetic acid, methyl ester
IUPAC
methyl 2-[3-(4-chlorophenoxy)-2-methyl-5-methylsulfonylindol-1-yl]acetate

Names & synonyms

INPDHLQEKDPTJM-UHFFFAOYSA-N3-(4-chlorophenoxy)-2-methyl-5-(methylsulfonyl)-1H-indole-1-acetic acid, methyl ester

Database identifiers

PubChem CID
86609234

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
83 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
27

Related reactions

2 records
New reaction record

Linked notes

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