cyclopentane; 1-(4-cyclopentylbutyl)-3-(phenylcarbonyl)pyrimidine-2,4-dione; iron(2+)

Systemtic Name: cyclopentane; 1-(4-cyclopentylbutyl)-3-(phenylcarbonyl)pyrimidine-2,4-dione; iron(2+) Openeye Name: ferrous; 3-benzoyl-1-(4-cyclopentylbutyl)pyrimidine-2,4-dione; cyclopentane CAS Name: 3-benzoyl-1-(4-cyclopentylbutyl)pyrimidine-2,4-dione; cyclopentane; iron(2+) IUPAC Name: 3-benzoyl-1-(4-cyclopentylbutyl)pyrimidine-2,4-dione; cyclopentane; iron(2+) Traditional Name: ferrous; 3-benzoyl-1-(4-cyclopentylbutyl)pyrimidine-2,4-quinone; cyclopentane Formula: C25H24FeN2O3+2 MolecularWeight: 456.31466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N2C(=O)C=CN(C2=O)CCCC[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N2C(=O)C=CN(C2=O)CCCC[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C20H19N2O3.C5H5.Fe/c23-18-13-15-21(14-7-6-10-16-8-4-5-9-16)20(25)22(18)19(24)17-11-2-1-3-12-17;1-2-4-5-3-1;/h1-5,8-9,11-13,15H,6-7,10,14H2;1-5H;/q;;+2