Molecule ID: 15663323

IUPAC Name: N-hydroxy-2-(1H-indol-3-yl)ethanimine oxide

Description: The molecule is an aci-nitro compound resulting from the formal tautomerisation of the nitro group of 3-(2-nitroethyl)indole. It is an aci-nitro compound and a member of indoles.

SMILES: [O-][N+](O)=CCc1c[nH]c2ccccc12

SELFIES: [O-1][N+1][Branch1][C][O][=C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1]

InChI: InChI=1S/C10H10N2O2/c13-12(14)6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,6-7,11H,5H2,(H,13,14)

Molecular Properties:
- Polar Surface Area: 64.8 Ų
- LogP: 1.0