ditert-butyl 4-ethoxy-1-(6-methylpyridin-2-yl)-5-oxidanylidene-2H-pyrrole-2,3-dicarboxylate

Systemtic Name: ditert-butyl 4-ethoxy-1-(6-methylpyridin-2-yl)-5-oxidanylidene-2H-pyrrole-2,3-dicarboxylate Openeye Name: ditert-butyl 4-ethoxy-1-(6-methyl-2-pyridyl)-5-oxo-2H-pyrrole-2,3-dicarboxylate CAS Name: 4-ethoxy-1-(6-methyl-2-pyridinyl)-5-oxo-2H-pyrrole-2,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 4-ethoxy-1-(6-methylpyridin-2-yl)-5-oxo-2H-pyrrole-2,3-dicarboxylate Traditional Name: 4-ethoxy-5-keto-1-(6-methyl-2-pyridyl)-3-pyrroline-2,3-dicarboxylic acid ditert-butyl ester Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(N(C1=O)C2=CC=CC(=N2)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=C(C(N(C1=O)C2=CC=CC(=N2)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H30N2O6/c1-9-28-17-15(19(26)29-21(3,4)5)16(20(27)30-22(6,7)8)24(18(17)25)14-12-10-11-13(2)23-14/h10-12,16H,9H2,1-8H3