ethyl 1-(6-ethoxy-5-nitro-pyrimidin-4-yl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(6-ethoxy-5-nitro-pyrimidin-4-yl)piperidine-3-carboxylate Openeye Name: ethyl 1-(6-ethoxy-5-nitro-pyrimidin-4-yl)piperidine-3-carboxylate CAS Name: 1-(6-ethoxy-5-nitro-4-pyrimidinyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-ethoxy-5-nitropyrimidin-4-yl)piperidine-3-carboxylate Traditional Name: 1-(6-ethoxy-5-nitro-pyrimidin-4-yl)nipecotic acid ethyl ester Formula: C14H20N4O5 MolecularWeight: 324.3324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCCC(C2)C(=O)OCC

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCCC(C2)C(=O)OCC

InChI

InChI=1S/C14H20N4O5/c1-3-22-13-11(18(20)21)12(15-9-16-13)17-7-5-6-10(8-17)14(19)23-4-2/h9-10H,3-8H2,1-2H3