ethyl 4-[2-[3-methyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethanoylamino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-methyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethanoylamino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[3-methyl-4-[[2-(5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[3-methyl-4-[[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxoethyl]amino]-1-pyrazolyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-methyl-4-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-methyl-4-[[2-(5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]pyrazol-1-yl]propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H28N8O6 MolecularWeight: 476.48632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C=C(C(=N2)C)NC(=O)CN3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(C)N2C=C(C(=N2)C)NC(=O)CN3C(=CC(=N3)[N+](=O)[O-])C

InChI

InChI=1S/C20H28N8O6/c1-5-34-20(31)25-8-6-24(7-9-25)19(30)15(4)27-11-16(14(3)22-27)21-18(29)12-26-13(2)10-17(23-26)28(32)33/h10-11,15H,5-9,12H2,1-4H3,(H,21,29)