ethyl 4-{7-bromo-1-[2-(ethyloxy)-2-oxoethyl]-1H-indol-3-yl}butanoate

HCID 66738782
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Basic information

Standard SMILES
CCOC(=O)CCCc1cn(CC(=O)OCC)c2c(Br)cccc12
InChIKey
RXTSOEAMDRZDFJ-UHFFFAOYSA-N
Molecular formula
C18H22BrNO4
Average molar mass
396.3 g/mol

Names & identifiers

Preferred name
ethyl 4-{7-bromo-1-[2-(ethyloxy)-2-oxoethyl]-1H-indol-3-yl}butanoate
IUPAC
ethyl 4-[7-bromo-1-(2-ethoxy-2-oxoethyl)indol-3-yl]butanoate

Names & synonyms

SCHEMBL596868RXTSOEAMDRZDFJ-UHFFFAOYSA-Nethyl 4-{7-bromo-1-[2-(ethyloxy)-2-oxoethyl]-1H-indol-3-yl}butanoate

Database identifiers

PubChem CID
66738782

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
57.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
24

Related reactions

5 records
New reaction record

Linked notes

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