propyl 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C(=C(N1)C)C(=O)C)C

Isomeric SMILES

CCCOC(=O)C1=C(C(=C(N1)C)C(=O)C)C

InChI

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