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

Systemtic Name: ethyl 4-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-[6-(1-imidazolyl)-5-nitro-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-imidazol-1-yl-5-nitropyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylic acid ethyl ester Formula: C14H17N7O4 MolecularWeight: 347.32928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C14H17N7O4/c1-2-25-14(22)19-7-5-18(6-8-19)12-11(21(23)24)13(17-9-16-12)20-4-3-15-10-20/h3-4,9-10H,2,5-8H2,1H3