ethyl 2-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazol-3-yl)carbonylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazol-3-yl)carbonylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazole-3-carbonyl)amino]piperidine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[4-[[(2-ethyl-5-methyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-[(2-ethyl-5-methyl-4-nitropyrazole-3-carbonyl)amino]piperidine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[4-[(2-ethyl-5-methyl-4-nitro-pyrazole-3-carbonyl)amino]isonipecotoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C24H32N6O6 MolecularWeight: 500.54748

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)[N+](=O)[O-])C(=O)NC2(CCNCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN1C(=C(C(=N1)C)[N+](=O)[O-])C(=O)NC2(CCNCC2)C(=O)NC(CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C24H32N6O6/c1-4-29-20(19(30(34)35)16(3)28-29)21(31)27-24(11-13-25-14-12-24)23(33)26-18(22(32)36-5-2)15-17-9-7-6-8-10-17/h6-10,18,25H,4-5,11-15H2,1-3H3,(H,26,33)(H,27,31)