cyclopentane; (S)-cyclopentyl-phenyl-(2-propan-2-ylsulfanylcyclopentyl)methanol; iron(2+)

Systemtic Name: cyclopentane; (S)-cyclopentyl-phenyl-(2-propan-2-ylsulfanylcyclopentyl)methanol; iron(2+) Openeye Name: diferrous; cyclopentane; (S)-cyclopentyl-(2-isopropylsulfanylcyclopentyl)-phenyl-methanol CAS Name: cyclopentane; (S)-cyclopentyl-phenyl-[2-(propan-2-ylthio)cyclopentyl]methanol; iron(2+) IUPAC Name: cyclopentane; (S)-cyclopentyl-phenyl-(2-propan-2-ylsulfanylcyclopentyl)methanol; iron(2+) Traditional Name: diferrous; cyclopentane; (S)-cyclopentyl-[2-(isopropylthio)cyclopentyl]-phenyl-methanol Formula: C30H30Fe2OS+4 MolecularWeight: 550.3136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S[C]1[CH][CH][CH][C]1C(C2=CC=CC=C2)([C]3[CH][CH][CH][CH]3)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

Isomeric SMILES

CC(C)S[C]1[CH][CH][CH][C]1[C@](C2=CC=CC=C2)([C]3[CH][CH][CH][CH]3)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C20H20OS.2C5H5.2Fe/c1-15(2)22-19-14-8-13-18(19)20(21,17-11-6-7-12-17)16-9-4-3-5-10-16;2*1-2-4-5-3-1;;/h3-15,21H,1-2H3;2*1-5H;;/q;;;2*+2/t20-;;;;/m0..../s1