3-(2-carboxyethyl)-5-ethoxycarbonyl-4-ethyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3-(2-carboxyethyl)-5-ethoxycarbonyl-4-ethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 3-(2-carboxyethyl)-5-ethoxycarbonyl-4-ethyl-1H-pyrrole-2-carboxylic acid CAS Name: 3-(2-carboxyethyl)-5-ethoxycarbonyl-4-ethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-(2-carboxyethyl)-5-ethoxycarbonyl-4-ethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 5-carbethoxy-3-(2-carboxyethyl)-4-ethyl-1H-pyrrole-2-carboxylic acid Formula: C13H17NO6 MolecularWeight: 283.27718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1CCC(=O)O)C(=O)O)C(=O)OCC

Isomeric SMILES

CCC1=C(NC(=C1CCC(=O)O)C(=O)O)C(=O)OCC

InChI

InChI=1S/C13H17NO6/c1-3-7-8(5-6-9(15)16)10(12(17)18)14-11(7)13(19)20-4-2/h14H,3-6H2,1-2H3,(H,15,16)(H,17,18)