(2S,4S)-4-acetylthio-2-formyl-1-(4-nitrobenzyloxycarbonyl)pyrrolidine

HCID 18638815

Basic information

Standard SMILES
CC(=O)S[C@H]1C[C@@H](C=O)N(C(=O)OCc2ccc([N+](=O)[O-])cc2)C1
InChIKey
AXARQGIFBJGXJA-KBPBESRZSA-N
Molecular formula
C15H16N2O6S
Average molar mass
352.4 g/mol

Names & identifiers

Preferred name
(2S,4S)-4-acetylthio-2-formyl-1-(4-nitrobenzyloxycarbonyl)pyrrolidine
IUPAC
(4-nitrophenyl)methyl (2S,4S)-4-acetylsulfanyl-2-formylpyrrolidine-1-carboxylate

Names & synonyms

SCHEMBL9261506AXARQGIFBJGXJA-KBPBESRZSA-N(2S,4S)-4-acetylthio-2-formyl-1-(4-nitrobenzyloxycarbonyl) pyrrolidine(2S,4S)-4-acetylthio-2-formyl-1-(4-nitrobenzyloxycarbonyl)pyrrolidine

Database identifiers

PubChem CID
18638815

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
135 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
24

Related reactions

6 records

Linked notes

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