diethyl 5-(3-ethoxycarbonyl-4-oxidanyl-pyrazol-1-yl)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-(3-ethoxycarbonyl-4-oxidanyl-pyrazol-1-yl)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(3-ethoxycarbonyl-4-hydroxy-pyrazol-1-yl)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-(3-ethoxycarbonyl-4-hydroxy-1-pyrazolyl)-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(3-ethoxycarbonyl-4-hydroxypyrazol-1-yl)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(3-carbethoxy-4-hydroxy-pyrazol-1-yl)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C17H20N2O7S MolecularWeight: 396.4149

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)N2C=C(C(=N2)C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)N2C=C(C(=N2)C(=O)OCC)O

InChI

InChI=1S/C17H20N2O7S/c1-5-24-15(21)11-9(4)13(17(23)26-7-3)27-14(11)19-8-10(20)12(18-19)16(22)25-6-2/h8,20H,5-7H2,1-4H3