Dimethyl 2-(3-{[(anilinocarbonyl)oxy]methyl}benzyl)malonate

HCID 57719975
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Basic information

Standard SMILES
COC(=O)C(Cc1cccc(COC(=O)Nc2ccccc2)c1)C(=O)OC
InChIKey
UOOPVWUVVHFVBD-UHFFFAOYSA-N
Molecular formula
C20H21NO6
Average molar mass
371.4 g/mol

Names & identifiers

Preferred name
Dimethyl 2-(3-{[(anilinocarbonyl)oxy]methyl}benzyl)malonate
IUPAC
dimethyl 2-[[3-(phenylcarbamoyloxymethyl)phenyl]methyl]propanedioate

Names & synonyms

SCHEMBL13810333UOOPVWUVVHFVBD-UHFFFAOYSA-NDimethyl 2-(3-{[(anilinocarbonyl)oxy]methyl}benzyl)malonate

Database identifiers

PubChem CID
57719975

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
90.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
27

Related reactions

2 records
New reaction record

Compound notes

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