cyclopentane; ethyl 5-cyclopentyl-1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]pyrazole-3-carboxylate; iron(2+)

Systemtic Name: cyclopentane; ethyl 5-cyclopentyl-1-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]pyrazole-3-carboxylate; iron(2+) Openeye Name: ferrous; cyclopentane; ethyl 5-cyclopentyl-1-[2-(4-methoxyphenyl)-2-oxo-ethyl]pyrazole-3-carboxylate CAS Name: cyclopentane; 5-cyclopentyl-1-[2-(4-methoxyphenyl)-2-oxoethyl]-3-pyrazolecarboxylic acid ethyl ester; iron(2+) IUPAC Name: cyclopentane; ethyl 5-cyclopentyl-1-[2-(4-methoxyphenyl)-2-oxoethyl]pyrazole-3-carboxylate; iron(2+) Traditional Name: ferrous; cyclopentane; 5-cyclopentyl-1-[2-keto-2-(4-methoxyphenyl)ethyl]pyrazole-3-carboxylic acid ethyl ester Formula: C25H24FeN2O4+2 MolecularWeight: 472.31406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)[C]2[CH][CH][CH][CH]2)CC(=O)C3=CC=C(C=C3)OC.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)[C]2[CH][CH][CH][CH]2)CC(=O)C3=CC=C(C=C3)OC.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C20H19N2O4.C5H5.Fe/c1-3-26-20(24)17-12-18(14-6-4-5-7-14)22(21-17)13-19(23)15-8-10-16(25-2)11-9-15;1-2-4-5-3-1;/h4-12H,3,13H2,1-2H3;1-5H;/q;;+2