dimethyl 1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-nitro-pyrazole-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-nitro-pyrazole-3,5-dicarboxylate Openeye Name: dimethyl 1-[2-(tert-butoxycarbonylamino)ethyl]-4-nitro-pyrazole-3,5-dicarboxylate CAS Name: 1-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-4-nitropyrazole-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-4-nitropyrazole-3,5-dicarboxylate Traditional Name: 1-[2-(tert-butoxycarbonylamino)ethyl]-4-nitro-pyrazole-3,5-dicarboxylic acid dimethyl ester Formula: C14H20N4O8 MolecularWeight: 372.3306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN1C(=C(C(=N1)C(=O)OC)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCN1C(=C(C(=N1)C(=O)OC)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H20N4O8/c1-14(2,3)26-13(21)15-6-7-17-10(12(20)25-5)9(18(22)23)8(16-17)11(19)24-4/h6-7H2,1-5H3,(H,15,21)