cyclopentane; ethyl 5-cyclopentyl-2-ethanoyl-1,3-dihydroindene-2-carboxylate; iron(2+)

Systemtic Name: cyclopentane; ethyl 5-cyclopentyl-2-ethanoyl-1,3-dihydroindene-2-carboxylate; iron(2+) Openeye Name: ferrous; cyclopentane; ethyl 2-acetyl-5-cyclopentyl-indane-2-carboxylate CAS Name: 2-acetyl-5-cyclopentyl-1,3-dihydroindene-2-carboxylic acid ethyl ester; cyclopentane; iron(2+) IUPAC Name: cyclopentane; ethyl 2-acetyl-5-cyclopentyl-1,3-dihydroindene-2-carboxylate; iron(2+) Traditional Name: ferrous; 2-acetyl-5-cyclopentyl-indane-2-carboxylic acid ethyl ester; cyclopentane Formula: C24H24FeO3+2 MolecularWeight: 416.29056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=C(C1)C=C(C=C2)[C]3[CH][CH][CH][CH]3)C(=O)C.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CCOC(=O)C1(CC2=C(C1)C=C(C=C2)[C]3[CH][CH][CH][CH]3)C(=O)C.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C19H19O3.C5H5.Fe/c1-3-22-18(21)19(13(2)20)11-16-9-8-15(10-17(16)12-19)14-6-4-5-7-14;1-2-4-5-3-1;/h4-10H,3,11-12H2,1-2H3;1-5H;/q;;+2