5-ethoxycarbonyl-4-methyl-3-propanoyloxy-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-ethoxycarbonyl-4-methyl-3-propanoyloxy-1H-pyrrole-2-carboxylic acid Openeye Name: 5-ethoxycarbonyl-4-methyl-3-propanoyloxy-1H-pyrrole-2-carboxylic acid CAS Name: 5-ethoxycarbonyl-4-methyl-3-(1-oxopropoxy)-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-ethoxycarbonyl-4-methyl-3-propanoyloxy-1H-pyrrole-2-carboxylic acid Traditional Name: 5-carbethoxy-4-methyl-3-propionyloxy-1H-pyrrole-2-carboxylic acid Formula: C12H15NO6 MolecularWeight: 269.2506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(NC(=C1C)C(=O)OCC)C(=O)O

Isomeric SMILES

CCC(=O)OC1=C(NC(=C1C)C(=O)OCC)C(=O)O

InChI

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