Dibenzyl 2-(6-phthalimidohexylidene)malonate

HCID 19087618
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Basic information

Standard SMILES
O=C(OCc1ccccc1)C(=CCCCCCN1C(=O)c2ccccc2C1=O)C(=O)OCc1ccccc1
InChIKey
PFMKBNHGNFSISG-UHFFFAOYSA-N
Molecular formula
C31H29NO6
Average molar mass
511.6 g/mol

Names & identifiers

Preferred name
Dibenzyl 2-(6-phthalimidohexylidene)malonate
IUPAC
dibenzyl 2-[6-(1,3-dioxoisoindol-2-yl)hexylidene]propanedioate

Names & synonyms

SCHEMBL9329980PFMKBNHGNFSISG-UHFFFAOYSA-Ndibenzyl 2-(6-phthalimidohexylidene)malonate

Database identifiers

PubChem CID
19087618

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
90 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
14
Heavy atoms
38

Related reactions

2 records
New reaction record

Compound notes

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