cyclopentane; iron(2+); methyl (1S)-1-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,2-dihydropentalene-2-carboxylate

Systemtic Name: cyclopentane; iron(2+); methyl (1S)-1-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,2-dihydropentalene-2-carboxylate Openeye Name: ferrous; cyclopentane; methyl (1S)-1-(2-methoxy-2-oxo-ethyl)-3-oxo-1,2-dihydropentalene-2-carboxylate CAS Name: cyclopentane; iron(2+); (1S)-1-(2-methoxy-2-oxoethyl)-3-oxo-1,2-dihydropentalene-2-carboxylic acid methyl ester IUPAC Name: cyclopentane; iron(2+); methyl (1S)-1-(2-methoxy-2-oxoethyl)-3-oxo-1,2-dihydropentalene-2-carboxylate Traditional Name: ferrous; cyclopentane; (1S)-3-keto-1-(2-keto-2-methoxy-ethyl)-1,2-dihydropentalene-2-carboxylic acid methyl ester Formula: C18H18FeO5+2 MolecularWeight: 370.17752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(C(=O)[C]2[C]1[CH][CH][CH]2)C(=O)OC.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

COC(=O)C[C@@H]1C(C(=O)[C]2[C]1[CH][CH][CH]2)C(=O)OC.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C13H13O5.C5H5.Fe/c1-17-10(14)6-9-7-4-3-5-8(7)12(15)11(9)13(16)18-2;1-2-4-5-3-1;/h3-5,9,11H,6H2,1-2H3;1-5H;/q;;+2/t9-,11?;;/m0../s1