ethyl 5-ethanoyl-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 5-acetyl-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-acetyl-4-ethyl-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-acetyl-4-ethyl-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO3/c1-5-9-7(3)10(12(15)16-6-2)13-11(9)8(4)14/h13H,5-6H2,1-4H3