Molecule ID: 126456448

IUPAC Name: N-hydroxy-4-methylsulfanylbutan-1-imine oxide

Description: The molecule is an aci-nitro compound resulting from the formal oxidation of the oxime nitrogen of an omega-(methylsulfany)-(E)-alkanal oxime. It is an aci-nitro compound and a methyl sulfide. It derives from an omega-(methylsulfanyl)-(E)-alkanal oxime.

SMILES: CSCCCC=[N+]([O-])O

SELFIES: [C][S][C][C][C][C][=N+1][Branch1][C][O-1][O]

InChI: InChI=1S/C5H11NO2S/c1-9-5-3-2-4-6(7)8/h4H,2-3,5H2,1H3,(H,7,8)

Molecular Properties:
- Polar Surface Area: 74.3 Ų
- LogP: 0.4