cyclopentane; iron(2+); N-(2-sulfanidylethyl)cyclopentanecarboximidate

Systemtic Name: cyclopentane; iron(2+); N-(2-sulfanidylethyl)cyclopentanecarboximidate Openeye Name: ferrous; cyclopentane; N-(2-sulfidoethyl)cyclopentanecarboximidate CAS Name: cyclopentane; iron(2+); N-(2-sulfidoethyl)cyclopentanecarboximidate IUPAC Name: cyclopentane; iron(2+); N-(2-sulfidoethyl)cyclopentanecarboximidate Traditional Name: ferrous; cyclopentane; N-(2-sulfidoethyl)cyclopentanecarboximidate Formula: C13H13FeNOS MolecularWeight: 287.15842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][C]([CH]1)C(=NCC[S-])[O-].[Fe+2]

Isomeric SMILES

[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][C]([CH]1)C(=NCC[S-])[O-].[Fe+2]

InChI

InChI=1S/C8H10NOS.C5H5.Fe/c10-8(9-5-6-11)7-3-1-2-4-7;1-2-4-5-3-1;/h1-4,11H,5-6H2,(H,9,10);1-5H;/q;;+2/p-2