cyclopentyl-[4-(1-cyclopentylcarbonylpiperidin-4-yl)piperidin-1-yl]methanone; iron; methyl cyclopentanecarboxylate

Systemtic Name: cyclopentyl-[4-(1-cyclopentylcarbonylpiperidin-4-yl)piperidin-1-yl]methanone; iron; methyl cyclopentanecarboxylate Openeye Name: [4-[1-(cyclopentanecarbonyl)-4-piperidyl]-1-piperidyl]-cyclopentyl-methanone; iron; methyl cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid methyl ester; cyclopentyl-[4-[1-[cyclopentyl(oxo)methyl]-4-piperidinyl]-1-piperidinyl]methanone; iron IUPAC Name: [4-[1-(cyclopentanecarbonyl)piperidin-4-yl]piperidin-1-yl]-cyclopentylmethanone; iron; methyl cyclopentanecarboxylate Traditional Name: [4-[1-(cyclopentanecarbonyl)-4-piperidyl]piperidino]-cyclopentyl-methanone; cyclopentanecarboxylic acid methyl ester; iron Formula: C36H40Fe2N2O6 MolecularWeight: 708.4026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)[C]1[CH][CH][CH][CH]1.COC(=O)[C]1[CH][CH][CH][CH]1.C1CN(CCC1C2CCN(CC2)C(=O)[C]3[CH][CH][CH][CH]3)C(=O)[C]4[CH][CH][CH][CH]4.[Fe].[Fe]

Isomeric SMILES

COC(=O)[C]1[CH][CH][CH][CH]1.COC(=O)[C]1[CH][CH][CH][CH]1.C1CN(CCC1C2CCN(CC2)C(=O)[C]3[CH][CH][CH][CH]3)C(=O)[C]4[CH][CH][CH][CH]4.[Fe].[Fe]

InChI

InChI=1S/C22H26N2O2.2C7H7O2.2Fe/c25-21(19-5-1-2-6-19)23-13-9-17(10-14-23)18-11-15-24(16-12-18)22(26)20-7-3-4-8-20;2*1-9-7(8)6-4-2-3-5-6;;/h1-8,17-18H,9-16H2;2*2-5H,1H3;;