ethyl 4-[6-(2-methoxyphenoxy)-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-(2-methoxyphenoxy)-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[6-(2-methoxyphenoxy)-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[6-(2-methoxyphenoxy)-5-nitro-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-(2-methoxyphenoxy)-5-nitropyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[6-(2-methoxyphenoxy)-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C18H21N5O6 MolecularWeight: 403.38924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)OC3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)OC3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O6/c1-3-28-18(24)22-10-8-21(9-11-22)16-15(23(25)26)17(20-12-19-16)29-14-7-5-4-6-13(14)27-2/h4-7,12H,3,8-11H2,1-2H3