ethyl 1-[6-(2,5-dimethylpyrazol-3-yl)oxy-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[6-(2,5-dimethylpyrazol-3-yl)oxy-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-(2,5-dimethylpyrazol-3-yl)oxy-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[6-[(2,5-dimethyl-3-pyrazolyl)oxy]-5-nitro-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(2,5-dimethylpyrazol-3-yl)oxy-5-nitropyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-(2,5-dimethylpyrazol-3-yl)oxy-5-nitro-pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C17H22N6O5 MolecularWeight: 390.39378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)OC3=CC(=NN3C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)OC3=CC(=NN3C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H22N6O5/c1-4-27-17(24)12-5-7-22(8-6-12)15-14(23(25)26)16(19-10-18-15)28-13-9-11(2)20-21(13)3/h9-10,12H,4-8H2,1-3H3