3-(4-chlorophenyl)sulfanyl-1-cyclopentyl-propan-1-one; iron(2+)

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-cyclopentyl-propan-1-one; iron(2+) Openeye Name: ferrous 3-(4-chlorophenyl)sulfanyl-1-cyclopentyl-propan-1-one CAS Name: 3-[(4-chlorophenyl)thio]-1-cyclopentyl-1-propanone; iron(2+) IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-cyclopentylpropan-1-one; iron(2+) Traditional Name: ferrous 3-[(4-chlorophenyl)thio]-1-cyclopentyl-propan-1-one Formula: C28H24Cl2FeO2S2+2 MolecularWeight: 583.36996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCC(=O)[C]2[CH][CH][CH][CH]2)Cl.C1=CC(=CC=C1SCCC(=O)[C]2[CH][CH][CH][CH]2)Cl.[Fe+2]

Isomeric SMILES

C1=CC(=CC=C1SCCC(=O)[C]2[CH][CH][CH][CH]2)Cl.C1=CC(=CC=C1SCCC(=O)[C]2[CH][CH][CH][CH]2)Cl.[Fe+2]

InChI

InChI=1S/2C14H12ClOS.Fe/c2*15-12-5-7-13(8-6-12)17-10-9-14(16)11-3-1-2-4-11;/h2*1-8H,9-10H2;/q;;+2