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

Systemtic Name: 1,2-oxazol-5-ylmethyl 4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: isoxazol-5-ylmethyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid 5-isoxazolylmethyl ester IUPAC Name: 1,2-oxazol-5-ylmethyl 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid isoxazol-5-ylmethyl ester Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)OCC2=CC=NO2

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)OCC2=CC=NO2

InChI

InChI=1S/C13H14N2O4/c1-7-11(9(3)16)8(2)15-12(7)13(17)18-6-10-4-5-14-19-10/h4-5,15H,6H2,1-3H3