[(2R,3S,4R,5R,6S)-3,4-bis(acetyloxy)-6-chloro-5-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)oxan-2-yl]methyl acetate

HCID 3645103
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)OCC1OC(Cl)C(N2C(=O)c3ccccc3C2=O)C(OC(C)=O)C1OC(C)=O
InChIKey
YRXSTYGMBJFQAY-UHFFFAOYSA-N
Molecular formula
C20H20ClNO9
Average molar mass
453.8 g/mol

Names & identifiers

Preferred name
[(2R,3S,4R,5R,6S)-3,4-bis(acetyloxy)-6-chloro-5-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)oxan-2-yl]methyl acetate
IUPAC
[3,4-diacetyloxy-6-chloro-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl acetate

Names & synonyms

[(2R,3S,4R,5R,6S)-3,4-bis(acetyloxy)-6-chloro-5-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)oxan-2-yl]methyl acetate

Database identifiers

PubChem CID
3645103

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
126 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
8
Heavy atoms
31

Related reactions

2 records
New reaction record

Compound notes

Loading…