O2-tert-butyl O3-ethyl 5-iodanyl-4-methyl-1H-pyrrole-2,3-dicarboxylate

Systemtic Name: O2-tert-butyl O3-ethyl 5-iodanyl-4-methyl-1H-pyrrole-2,3-dicarboxylate Openeye Name: O2-tert-butyl O3-ethyl 5-iodo-4-methyl-1H-pyrrole-2,3-dicarboxylate CAS Name: 5-iodo-4-methyl-1H-pyrrole-2,3-dicarboxylic acid O2-tert-butyl ester O3-ethyl ester IUPAC Name: 2-O-tert-butyl 3-O-ethyl 5-iodo-4-methyl-1H-pyrrole-2,3-dicarboxylate Traditional Name: 5-iodo-4-methyl-1H-pyrrole-2,3-dicarboxylic acid O2-tert-butyl ester O3-ethyl ester Formula: C13H18INO4 MolecularWeight: 379.19079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)I)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)I)C(=O)OC(C)(C)C

InChI

InChI=1S/C13H18INO4/c1-6-18-11(16)8-7(2)10(14)15-9(8)12(17)19-13(3,4)5/h15H,6H2,1-5H3