O5-[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl] O3-ethyl (3S)-2-(4-methylphenyl)-3,4-dihydropyrazole-3,5-dicarboxylate

Systemtic Name: O5-[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl] O3-ethyl (3S)-2-(4-methylphenyl)-3,4-dihydropyrazole-3,5-dicarboxylate Openeye Name: O5-[(1S)-2-ethoxy-1-methyl-2-oxo-ethyl] O3-ethyl (3S)-2-(p-tolyl)-3,4-dihydropyrazole-3,5-dicarboxylate CAS Name: (3S)-2-(4-methylphenyl)-3,4-dihydropyrazole-3,5-dicarboxylic acid O5-[(2S)-1-ethoxy-1-oxopropan-2-yl] ester O3-ethyl ester IUPAC Name: 5-O-[(2S)-1-ethoxy-1-oxopropan-2-yl] 3-O-ethyl (3S)-2-(4-methylphenyl)-3,4-dihydropyrazole-3,5-dicarboxylate Traditional Name: (5S)-1-(p-tolyl)-2-pyrazoline-3,5-dicarboxylic acid O3-[(1S)-2-ethoxy-2-keto-1-methyl-ethyl] ester O5-ethyl ester Formula: C19H24N2O6 MolecularWeight: 376.40366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=NN1C2=CC=C(C=C2)C)C(=O)OC(C)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@@H]1CC(=NN1C2=CC=C(C=C2)C)C(=O)O[C@@H](C)C(=O)OCC

InChI

InChI=1S/C19H24N2O6/c1-5-25-17(22)13(4)27-18(23)15-11-16(19(24)26-6-2)21(20-15)14-9-7-12(3)8-10-14/h7-10,13,16H,5-6,11H2,1-4H3/t13-,16-/m0/s1