bis[2-[(S)-tert-butylsulfinyl]cyclopentyl]-phenyl-methanol; cyclopentane; iron(2+)

Systemtic Name: bis[2-[(S)-tert-butylsulfinyl]cyclopentyl]-phenyl-methanol; cyclopentane; iron(2+) Openeye Name: diferrous; bis[2-[(S)-tert-butylsulfinyl]cyclopentyl]-phenyl-methanol; cyclopentane CAS Name: bis[2-[(S)-tert-butylsulfinyl]cyclopentyl]-phenylmethanol; cyclopentane; iron(2+) IUPAC Name: bis[2-[(S)-tert-butylsulfinyl]cyclopentyl]-phenylmethanol; cyclopentane; iron(2+) Traditional Name: diferrous; bis[2-[(S)-tert-butylsulfinyl]cyclopentyl]-phenyl-methanol; cyclopentane Formula: C35H40Fe2O3S2+4 MolecularWeight: 684.5103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30O3S2.2C5H5.2Fe/c1-23(2,3)29(27)21-16-10-14-19(21)25(26,18-12-8-7-9-13-18)20-15-11-17-22(20)30(28)24(4,5)6;2*1-2-4-5-3-1;;/h7-17,26H,1-6H3;2*1-5H;;/q;;;2*+2/t29-,30-;;;;/m0..../s1