cyclopentane; (1S)-1-[2-(2-cyclopentylethynyl)pyrimidin-5-yl]-2-methyl-propan-1-ol; iron(2+)

Systemtic Name: cyclopentane; (1S)-1-[2-(2-cyclopentylethynyl)pyrimidin-5-yl]-2-methyl-propan-1-ol; iron(2+) Openeye Name: ferrous; cyclopentane; (1S)-1-[2-(2-cyclopentylethynyl)pyrimidin-5-yl]-2-methyl-propan-1-ol CAS Name: cyclopentane; (1S)-1-[2-(2-cyclopentylethynyl)-5-pyrimidinyl]-2-methyl-1-propanol; iron(2+) IUPAC Name: cyclopentane; (1S)-1-[2-(2-cyclopentylethynyl)pyrimidin-5-yl]-2-methylpropan-1-ol; iron(2+) Traditional Name: ferrous; cyclopentane; (1S)-1-[2-(2-cyclopentylethynyl)pyrimidin-5-yl]-2-methyl-propan-1-ol Formula: C20H20FeN2O+2 MolecularWeight: 360.2306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CN=C(N=C1)C#C[C]2[CH][CH][CH][CH]2)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC(C)[C@@H](C1=CN=C(N=C1)C#C[C]2[CH][CH][CH][CH]2)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C15H15N2O.C5H5.Fe/c1-11(2)15(18)13-9-16-14(17-10-13)8-7-12-5-3-4-6-12;1-2-4-5-3-1;/h3-6,9-11,15,18H,1-2H3;1-5H;/q;;+2/t15-;;/m0../s1