5-ethoxycarbonyl-4-propyl-1H-pyrrole-2,3-dicarboxylic acid

Systemtic Name: 5-ethoxycarbonyl-4-propyl-1H-pyrrole-2,3-dicarboxylic acid Openeye Name: 5-ethoxycarbonyl-4-propyl-1H-pyrrole-2,3-dicarboxylic acid CAS Name: 5-ethoxycarbonyl-4-propyl-1H-pyrrole-2,3-dicarboxylic acid IUPAC Name: 5-ethoxycarbonyl-4-propyl-1H-pyrrole-2,3-dicarboxylic acid Traditional Name: 5-carbethoxy-4-propyl-1H-pyrrole-2,3-dicarboxylic acid Formula: C12H15NO6 MolecularWeight: 269.2506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1C(=O)O)C(=O)O)C(=O)OCC

Isomeric SMILES

CCCC1=C(NC(=C1C(=O)O)C(=O)O)C(=O)OCC

InChI

InChI=1S/C12H15NO6/c1-3-5-6-7(10(14)15)9(11(16)17)13-8(6)12(18)19-4-2/h13H,3-5H2,1-2H3,(H,14,15)(H,16,17)