ethyl 1-[5-nitro-6-[2-(2-oxidanylideneimidazolidin-1-yl)ethylamino]pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-nitro-6-[2-(2-oxidanylideneimidazolidin-1-yl)ethylamino]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-nitro-6-[2-(2-oxoimidazolidin-1-yl)ethylamino]pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-nitro-6-[2-(2-oxo-1-imidazolidinyl)ethylamino]-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-nitro-6-[2-(2-oxoimidazolidin-1-yl)ethylamino]pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-[2-(2-ketoimidazolidin-1-yl)ethylamino]-5-nitro-pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C17H25N7O5 MolecularWeight: 407.4243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NCCN3CCNC3=O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NCCN3CCNC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H25N7O5/c1-2-29-16(25)12-3-7-22(8-4-12)15-13(24(27)28)14(20-11-21-15)18-5-9-23-10-6-19-17(23)26/h11-12H,2-10H2,1H3,(H,19,26)(H,18,20,21)