tert-butyl N-[3-(cyclopentylcarbonylamino)propyl]carbamate; iron(2+); methyl cyclopentanecarboxylate

Systemtic Name: tert-butyl N-[3-(cyclopentylcarbonylamino)propyl]carbamate; iron(2+); methyl cyclopentanecarboxylate Openeye Name: ferrous; tert-butyl N-[3-(cyclopentanecarbonylamino)propyl]carbamate; methyl cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid methyl ester; N-[3-[[cyclopentyl(oxo)methyl]amino]propyl]carbamic acid tert-butyl ester; iron(2+) IUPAC Name: tert-butyl N-[3-(cyclopentanecarbonylamino)propyl]carbamate; iron(2+); methyl cyclopentanecarboxylate Traditional Name: ferrous; N-[3-(cyclopentanecarbonylamino)propyl]carbamic acid tert-butyl ester; cyclopentanecarboxylic acid methyl ester Formula: C21H28FeN2O5+2 MolecularWeight: 444.30242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N2O3.C7H7O2.Fe/c1-14(2,3)19-13(18)16-10-6-9-15-12(17)11-7-4-5-8-11;1-9-7(8)6-4-2-3-5-6;/h4-5,7-8H,6,9-10H2,1-3H3,(H,15,17)(H,16,18);2-5H,1H3;/q;;+2