cyclopentane; diethyl 2-acetamido-2-(4-cyclopentylbuta-2,3-dienyl)propanedioate; iron(2+)

Systemtic Name: cyclopentane; diethyl 2-acetamido-2-(4-cyclopentylbuta-2,3-dienyl)propanedioate; iron(2+) Openeye Name: ferrous; cyclopentane; diethyl 2-acetamido-2-(4-cyclopentylbuta-2,3-dienyl)propanedioate CAS Name: 2-acetamido-2-(4-cyclopentylbuta-2,3-dienyl)propanedioic acid diethyl ester; cyclopentane; iron(2+) IUPAC Name: cyclopentane; diethyl 2-acetamido-2-(4-cyclopentylbuta-2,3-dienyl)propanedioate; iron(2+) Traditional Name: ferrous; 2-acetamido-2-(4-cyclopentylbuta-2,3-dienyl)malonic acid diethyl ester; cyclopentane Formula: C23H27FeNO5+2 MolecularWeight: 453.30918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C=C[C]1[CH][CH][CH][CH]1)(C(=O)OCC)NC(=O)C.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CCOC(=O)C(CC=C=C[C]1[CH][CH][CH][CH]1)(C(=O)OCC)NC(=O)C.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C18H22NO5.C5H5.Fe/c1-4-23-16(21)18(19-14(3)20,17(22)24-5-2)13-9-8-12-15-10-6-7-11-15;1-2-4-5-3-1;/h6-7,9-12H,4-5,13H2,1-3H3,(H,19,20);1-5H;/q;;+2