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

Systemtic Name: ethyl 4-[2-[4-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]-3-methyl-pyrazol-1-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]-3-methyl-pyrazol-1-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-[[3-(3-methoxy-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-methyl-1-pyrazolyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-[3-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]-3-methylpyrazol-1-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-[3-(3-methoxy-4-nitro-pyrazol-1-yl)propanoylamino]-3-methyl-pyrazol-1-yl]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30N8O7 MolecularWeight: 506.5123

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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)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H30N8O7/c1-5-36-21(32)26-10-8-25(9-11-26)20(31)15(3)28-12-16(14(2)23-28)22-18(30)6-7-27-13-17(29(33)34)19(24-27)35-4/h12-13,15H,5-11H2,1-4H3,(H,22,30)