ethyl 4-[2-[3-methyl-4-[3-(3-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-methyl-4-[3-(3-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[3-methyl-4-[3-(3-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[3-methyl-4-[[3-(3-methyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-1-pyrazolyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-methyl-4-[3-(3-methyl-4-nitropyrazol-1-yl)propanoylamino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-methyl-4-[3-(3-methyl-4-nitro-pyrazol-1-yl)propanoylamino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30N8O6 MolecularWeight: 490.5129

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C=C(C(=N2)C)NC(=O)CCN3C=C(C(=N3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C=C(C(=N2)C)NC(=O)CCN3C=C(C(=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H30N8O6/c1-5-35-21(32)26-10-8-25(9-11-26)20(31)16(4)28-12-17(14(2)24-28)22-19(30)6-7-27-13-18(29(33)34)15(3)23-27/h12-13,16H,5-11H2,1-4H3,(H,22,30)