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

Systemtic Name: 3-ethoxycarbonyl-4-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 3-ethoxycarbonyl-4-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 3-ethoxycarbonyl-4-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-ethoxycarbonyl-4-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 3-carbethoxy-4-ethyl-5-methyl-1H-pyrrole-2-carboxylic acid Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OCC)C(=O)O)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC)C(=O)O)C

InChI

InChI=1S/C11H15NO4/c1-4-7-6(3)12-9(10(13)14)8(7)11(15)16-5-2/h12H,4-5H2,1-3H3,(H,13,14)