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

Systemtic Name: ethyl 4-[5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-nitro-6-[2-(4-nitrophenyl)hydrazino]pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[5-nitro-6-[(4-nitrophenyl)hydrazo]-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[5-nitro-6-[N'-(4-nitrophenyl)hydrazino]pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C17H20N8O6 MolecularWeight: 432.3907

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H20N8O6/c1-2-31-17(26)23-9-7-22(8-10-23)16-14(25(29)30)15(18-11-19-16)21-20-12-3-5-13(6-4-12)24(27)28/h3-6,11,20H,2,7-10H2,1H3,(H,18,19,21)