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

Systemtic Name: 5-ethoxycarbonyl-4-methyl-1H-pyrrole-3-carboxylic acid Openeye Name: 5-ethoxycarbonyl-4-methyl-1H-pyrrole-3-carboxylic acid CAS Name: 5-ethoxycarbonyl-4-methyl-1H-pyrrole-3-carboxylic acid IUPAC Name: 5-ethoxycarbonyl-4-methyl-1H-pyrrole-3-carboxylic acid Traditional Name: 5-carbethoxy-4-methyl-1H-pyrrole-3-carboxylic acid Formula: C9H11NO4 MolecularWeight: 197.18794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1)C(=O)O)C

InChI

InChI=1S/C9H11NO4/c1-3-14-9(13)7-5(2)6(4-10-7)8(11)12/h4,10H,3H2,1-2H3,(H,11,12)