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

Systemtic Name: ethyl 4-(6-ethoxy-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(6-ethoxy-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(6-ethoxy-5-nitro-4-pyrimidinyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-ethoxy-5-nitropyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(6-ethoxy-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylic acid ethyl ester Formula: C13H19N5O5 MolecularWeight: 325.32046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C13H19N5O5/c1-3-22-12-10(18(20)21)11(14-9-15-12)16-5-7-17(8-6-16)13(19)23-4-2/h9H,3-8H2,1-2H3