S-tert-butyl (3R)-3-cyclopentylbutanethioate; cyclopentane; iron(2+)

Systemtic Name: S-tert-butyl (3R)-3-cyclopentylbutanethioate; cyclopentane; iron(2+) Openeye Name: ferrous; S-tert-butyl (3R)-3-cyclopentylbutanethioate; cyclopentane CAS Name: cyclopentane; (3R)-3-cyclopentylbutanethioic acid S-tert-butyl ester; iron(2+) IUPAC Name: S-tert-butyl (3R)-3-cyclopentylbutanethioate; cyclopentane; iron(2+) Traditional Name: ferrous; cyclopentane; (3R)-3-cyclopentylbutanethioic acid S-tert-butyl ester Formula: C18H24FeOS+2 MolecularWeight: 344.29256

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)SC(C)(C)C)[C]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C[C@H](CC(=O)SC(C)(C)C)[C]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C13H19OS.C5H5.Fe/c1-10(11-7-5-6-8-11)9-12(14)15-13(2,3)4;1-2-4-5-3-1;/h5-8,10H,9H2,1-4H3;1-5H;/q;;+2/t10-;;/m1../s1