O4-methyl O2-(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-methyl O2-(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-methyl O2-(2-morpholino-2-oxo-1-phenyl-ethyl) 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O4-methyl ester O2-[2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: 4-O-methyl 2-O-(2-morpholin-4-yl-2-oxo-1-phenylethyl) 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-(2-keto-2-morpholino-1-phenyl-ethyl) ester O4-methyl ester Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)C)C(=O)OC

InChI

InChI=1S/C22H26N2O6/c1-4-16-17(21(26)28-3)14(2)18(23-16)22(27)30-19(15-8-6-5-7-9-15)20(25)24-10-12-29-13-11-24/h5-9,19,23H,4,10-13H2,1-3H3