cyclopentane; iron(2+); propan-2-yl (E)-2,3-di(cyclopentyl)prop-2-enoate

Systemtic Name: cyclopentane; iron(2+); propan-2-yl (E)-2,3-di(cyclopentyl)prop-2-enoate Openeye Name: diferrous; cyclopentane; isopropyl (E)-2,3-di(cyclopentyl)prop-2-enoate CAS Name: cyclopentane; (E)-2,3-di(cyclopentyl)-2-propenoic acid propan-2-yl ester; iron(2+) IUPAC Name: cyclopentane; iron(2+); propan-2-yl (E)-2,3-di(cyclopentyl)prop-2-enoate Traditional Name: diferrous; cyclopentane; (E)-2,3-di(cyclopentyl)acrylic acid isopropyl ester Formula: C26H26Fe2O2+4 MolecularWeight: 482.17344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)OC(=O)/C(=C/[C]1[CH][CH][CH][CH]1)/[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C16H16O2.2C5H5.2Fe/c1-12(2)18-16(17)15(14-9-5-6-10-14)11-13-7-3-4-8-13;2*1-2-4-5-3-1;;/h3-12H,1-2H3;2*1-5H;;/q;;;2*+2