bis[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl] 5,5-dimethylpyrazole-3,4-dicarboxylate

Systemtic Name: bis[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl] 5,5-dimethylpyrazole-3,4-dicarboxylate Openeye Name: bis[(1S)-2-ethoxy-1-methyl-2-oxo-ethyl] 5,5-dimethylpyrazole-3,4-dicarboxylate CAS Name: 5,5-dimethylpyrazole-3,4-dicarboxylic acid bis[(2S)-1-ethoxy-1-oxopropan-2-yl] ester IUPAC Name: bis[(2S)-1-ethoxy-1-oxopropan-2-yl] 5,5-dimethylpyrazole-3,4-dicarboxylate Traditional Name: 5,5-dimethylpyrazole-3,4-dicarboxylic acid bis[(1S)-2-ethoxy-2-keto-1-methyl-ethyl] ester Formula: C17H24N2O8 MolecularWeight: 384.38106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC(=O)C1=C(N=NC1(C)C)C(=O)OC(C)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@H](C)OC(=O)C1=C(N=NC1(C)C)C(=O)O[C@@H](C)C(=O)OCC

InChI

InChI=1S/C17H24N2O8/c1-7-24-13(20)9(3)26-15(22)11-12(18-19-17(11,5)6)16(23)27-10(4)14(21)25-8-2/h9-10H,7-8H2,1-6H3/t9-,10-/m0/s1