ethyl 4-[1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazol-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]pyrazole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]pyrazole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H23N7O5 MolecularWeight: 405.40842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C=C2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C=C2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H23N7O5/c1-4-29-17(26)21-9-7-20(8-10-21)16(25)14-5-6-22(19-14)11-23-13(3)15(24(27)28)12(2)18-23/h5-6H,4,7-11H2,1-3H3