cyclopentane; iron(2+); (2-phenylsulfanylcyclopentyl)methyl ethanoate

Systemtic Name: cyclopentane; iron(2+); (2-phenylsulfanylcyclopentyl)methyl ethanoate Openeye Name: ferrous; cyclopentane; (2-phenylsulfanylcyclopentyl)methyl acetate CAS Name: acetic acid [2-(phenylthio)cyclopentyl]methyl ester; cyclopentane; iron(2+) IUPAC Name: cyclopentane; iron(2+); (2-phenylsulfanylcyclopentyl)methyl acetate Traditional Name: ferrous; acetic acid [2-(phenylthio)cyclopentyl]methyl ester; cyclopentane Formula: C19H18FeO2S+2 MolecularWeight: 366.25502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC[C]1[CH][CH][CH][C]1SC2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC(=O)OC[C]1[CH][CH][CH][C]1SC2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C14H13O2S.C5H5.Fe/c1-11(15)16-10-12-6-5-9-14(12)17-13-7-3-2-4-8-13;1-2-4-5-3-1;/h2-9H,10H2,1H3;1-5H;/q;;+2