methyl 1-[5-nitro-6-[2-(4-nitrophenyl)carbonylhydrazinyl]pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[5-nitro-6-[2-(4-nitrophenyl)carbonylhydrazinyl]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: methyl 1-[5-nitro-6-[2-(4-nitrobenzoyl)hydrazino]pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-nitro-6-[[(4-nitrophenyl)-oxomethyl]hydrazo]-4-pyrimidinyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[5-nitro-6-[2-(4-nitrobenzoyl)hydrazinyl]pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[5-nitro-6-[N'-(4-nitrobenzoyl)hydrazino]pyrimidin-4-yl]isonipecotic acid methyl ester Formula: C18H19N7O7 MolecularWeight: 445.38616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N7O7/c1-32-18(27)12-6-8-23(9-7-12)16-14(25(30)31)15(19-10-20-16)21-22-17(26)11-2-4-13(5-3-11)24(28)29/h2-5,10,12H,6-9H2,1H3,(H,22,26)(H,19,20,21)