[2-[2-[2-(1-methylpyrazol-4-yl)carbonyloxyethanoylamino]ethylamino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate

Systemtic Name: [2-[2-[2-(1-methylpyrazol-4-yl)carbonyloxyethanoylamino]ethylamino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate Openeye Name: [2-[2-[[2-(1-methylpyrazole-4-carbonyl)oxyacetyl]amino]ethylamino]-2-oxo-ethyl] 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid [2-[2-[[2-[(1-methyl-4-pyrazolyl)-oxomethoxy]-1-oxoethyl]amino]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-[[2-(1-methylpyrazole-4-carbonyl)oxyacetyl]amino]ethylamino]-2-oxoethyl] 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid [2-keto-2-[2-[[2-(1-methylpyrazole-4-carbonyl)oxyacetyl]amino]ethylamino]ethyl] ester Formula: C16H20N6O6 MolecularWeight: 392.3666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)OCC(=O)NCCNC(=O)COC(=O)C2=CN(N=C2)C

Isomeric SMILES

CN1C=C(C=N1)C(=O)OCC(=O)NCCNC(=O)COC(=O)C2=CN(N=C2)C

InChI

InChI=1S/C16H20N6O6/c1-21-7-11(5-19-21)15(25)27-9-13(23)17-3-4-18-14(24)10-28-16(26)12-6-20-22(2)8-12/h5-8H,3-4,9-10H2,1-2H3,(H,17,23)(H,18,24)