3-(5-Benzyloxy-indol-1-yl)-hexanoic acid ethyl ester

HCID 67428014
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCC(CC(=O)OCC)n1ccc2cc(OCc3ccccc3)ccc21
InChIKey
BNRDETLPIRPMFF-UHFFFAOYSA-N
Molecular formula
C23H27NO3
Average molar mass
365.5 g/mol

Names & identifiers

Preferred name
3-(5-Benzyloxy-indol-1-yl)-hexanoic acid ethyl ester
IUPAC
ethyl 3-(5-phenylmethoxyindol-1-yl)hexanoate

Names & synonyms

SCHEMBL2493303BNRDETLPIRPMFF-UHFFFAOYSA-N3-(5-Benzyloxy-indol-1-yl)-hexanoic acid ethyl ester

Database identifiers

PubChem CID
67428014

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
40.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
10
Heavy atoms
27

Related reactions

2 records
New reaction record

Linked notes

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