1-(3,4-Dichloro-benzenesulfonyl)-1H-indole-2-carboxylic acid methyl ester

HCID 21705087
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Basic information

Standard SMILES
COC(=O)c1cc2ccccc2n1S(=O)(=O)c1ccc(Cl)c(Cl)c1
InChIKey
RWIVPTALKPRABH-UHFFFAOYSA-N
Molecular formula
C16H11Cl2NO4S
Average molar mass
384.2 g/mol
Monoisotopic mass
382.9785844

Names & identifiers

Preferred name
1-(3,4-Dichloro-benzenesulfonyl)-1H-indole-2-carboxylic acid methyl ester
IUPAC
methyl 1-(3,4-dichlorophenyl)sulfonylindole-2-carboxylate

Names & synonyms

1-(3,4-Dichloro-benzenesulfonyl)-1H-indole-2-carboxylic acid methyl ester220664-09-5MFCD19981454methyl 1-(3,4-dichlorophenyl)sulfonylindole-2-carboxylateMethyl 1-((3,4-dichlorophenyl)sulfonyl)-1H-indole-2-carboxylateC16H11Cl2NO4SSCHEMBL6963990RWIVPTALKPRABH-UHFFFAOYSA-NF317371Methyl N-(3,4-dichlorophenylsulphonyl)indole-2-carboxylate

Database identifiers

PubChem CID
21705087

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
73.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
24

Related reactions

2 records
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Compound notes

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