methyl 1-[6-[2-(furan-2-ylcarbonyl)hydrazinyl]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[6-[2-(furan-2-ylcarbonyl)hydrazinyl]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: methyl 1-[6-[2-(furan-2-carbonyl)hydrazino]-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[6-[[2-furanyl(oxo)methyl]hydrazo]-5-nitro-4-pyrimidinyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[6-[2-(furan-2-carbonyl)hydrazinyl]-5-nitropyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-[N'-(2-furoyl)hydrazino]-5-nitro-pyrimidin-4-yl]isonipecotic acid methyl ester Formula: C16H18N6O6 MolecularWeight: 390.35072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O6/c1-27-16(24)10-4-6-21(7-5-10)14-12(22(25)26)13(17-9-18-14)19-20-15(23)11-3-2-8-28-11/h2-3,8-10H,4-7H2,1H3,(H,20,23)(H,17,18,19)