diethyl 5-ethynyl-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-ethynyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-ethynyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethynyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-ethynyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethynyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)C#C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)C#C

InChI

InChI=1S/C13H15NO4/c1-5-9-10(12(15)17-6-2)8(4)11(14-9)13(16)18-7-3/h1,14H,6-7H2,2-4H3