7-(Benzyloxy)indole-3-glyoxylic acid methyl ester

HCID 69745137
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Basic information

Standard SMILES
COC(=O)C(=O)c1c[nH]c2c(OCc3ccccc3)cccc12
InChIKey
LJVITIRGZINWQZ-UHFFFAOYSA-N
Molecular formula
C18H15NO4
Average molar mass
309.3 g/mol

Names & identifiers

Preferred name
7-(Benzyloxy)indole-3-glyoxylic acid methyl ester
IUPAC
methyl 2-oxo-2-(7-phenylmethoxy-1H-indol-3-yl)acetate

Names & synonyms

SCHEMBL6334606LJVITIRGZINWQZ-UHFFFAOYSA-N7-(benzyloxy)indole-3-glyoxylic acid methyl ester

Database identifiers

PubChem CID
69745137

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
68.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
23

Related reactions

1 records
New reaction record

Compound notes

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