methyl 5-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxypyridine-3-carboxylate

Systemtic Name: methyl 5-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxypyridine-3-carboxylate Openeye Name: methyl 5-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxypyridine-3-carboxylate CAS Name: 5-[[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]oxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]oxypyridine-3-carboxylate Traditional Name: 5-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]oxynicotinic acid methyl ester Formula: C16H18N6O5 MolecularWeight: 374.35132

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)OC3=CN=CC(=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)OC3=CN=CC(=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O5/c1-20-3-5-21(6-4-20)14-13(22(24)25)15(19-10-18-14)27-12-7-11(8-17-9-12)16(23)26-2/h7-10H,3-6H2,1-2H3