ethyl 2-(3-cyclopentyl-3-oxidanylidene-propyl)sulfanylethanoate; iron(2+)

Systemtic Name: ethyl 2-(3-cyclopentyl-3-oxidanylidene-propyl)sulfanylethanoate; iron(2+) Openeye Name: ferrous ethyl 2-(3-cyclopentyl-3-oxo-propyl)sulfanylacetate CAS Name: 2-[(3-cyclopentyl-3-oxopropyl)thio]acetic acid ethyl ester; iron(2+) IUPAC Name: ethyl 2-(3-cyclopentyl-3-oxopropyl)sulfanylacetate; iron(2+) Traditional Name: ferrous 2-[(3-cyclopentyl-3-keto-propyl)thio]acetic acid ethyl ester Formula: C24H30FeO6S2+2 MolecularWeight: 534.4664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCCC(=O)[C]1[CH][CH][CH][CH]1.CCOC(=O)CSCCC(=O)[C]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CCOC(=O)CSCCC(=O)[C]1[CH][CH][CH][CH]1.CCOC(=O)CSCCC(=O)[C]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/2C12H15O3S.Fe/c2*1-2-15-12(14)9-16-8-7-11(13)10-5-3-4-6-10;/h2*3-6H,2,7-9H2,1H3;/q;;+2