cyclopentane; 4-cyclopentyl-6-(4-methoxyphenyl)pyrimidin-2-amine; iron(2+)

Systemtic Name: cyclopentane; 4-cyclopentyl-6-(4-methoxyphenyl)pyrimidin-2-amine; iron(2+) Openeye Name: ferrous; cyclopentane; 4-cyclopentyl-6-(4-methoxyphenyl)pyrimidin-2-amine CAS Name: cyclopentane; 4-cyclopentyl-6-(4-methoxyphenyl)-2-pyrimidinamine; iron(2+) IUPAC Name: cyclopentane; 4-cyclopentyl-6-(4-methoxyphenyl)pyrimidin-2-amine; iron(2+) Traditional Name: ferrous; cyclopentane; [4-cyclopentyl-6-(4-methoxyphenyl)pyrimidin-2-yl]amine Formula: C21H19FeN3O+2 MolecularWeight: 385.24006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=N2)N)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=N2)N)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C16H14N3O.C5H5.Fe/c1-20-13-8-6-12(7-9-13)15-10-14(18-16(17)19-15)11-4-2-3-5-11;1-2-4-5-3-1;/h2-10H,1H3,(H2,17,18,19);1-5H;/q;;+2