ethyl 4-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazol-3-yl)carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazol-3-yl)carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazole-3-carbonyl)amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[[(2-ethyl-5-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-4-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-[(2-ethyl-5-methyl-4-nitropyrazole-3-carbonyl)amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazole-3-carbonyl)amino]isonipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H33N7O6 MolecularWeight: 479.53002

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)[N+](=O)[O-])C(=O)NC2(CCNCC2)C(=O)NC3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCN1C(=C(C(=N1)C)[N+](=O)[O-])C(=O)NC2(CCNCC2)C(=O)NC3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C21H33N7O6/c1-4-27-17(16(28(32)33)14(3)25-27)18(29)24-21(8-10-22-11-9-21)19(30)23-15-6-12-26(13-7-15)20(31)34-5-2/h15,22H,4-13H2,1-3H3,(H,23,30)(H,24,29)