O2-[2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(4-acetamido-2-fluoro-phenyl)-2-oxo-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] ester O4-ethyl ester IUPAC Name: 2-O-[2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(4-acetamido-2-fluoro-phenyl)-2-keto-ethyl] ester O4-ethyl ester Formula: C20H21FN2O6 MolecularWeight: 404.388943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)C2=C(C=C(C=C2)NC(=O)C)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)C2=C(C=C(C=C2)NC(=O)C)F)C

InChI

InChI=1S/C20H21FN2O6/c1-5-28-19(26)17-10(2)18(22-11(17)3)20(27)29-9-16(25)14-7-6-13(8-15(14)21)23-12(4)24/h6-8,22H,5,9H2,1-4H3,(H,23,24)