diethyl 2-iodanyl-2-(2-pyrrol-1-ylethyl)propanedioate

Systemtic Name: diethyl 2-iodanyl-2-(2-pyrrol-1-ylethyl)propanedioate Openeye Name: diethyl 2-iodo-2-(2-pyrrol-1-ylethyl)propanedioate CAS Name: 2-iodo-2-[2-(1-pyrrolyl)ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-iodo-2-(2-pyrrol-1-ylethyl)propanedioate Traditional Name: 2-iodo-2-(2-pyrrol-1-ylethyl)malonic acid diethyl ester Formula: C13H18INO4 MolecularWeight: 379.19079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCN1C=CC=C1)(C(=O)OCC)I

Isomeric SMILES

CCOC(=O)C(CCN1C=CC=C1)(C(=O)OCC)I

InChI

InChI=1S/C13H18INO4/c1-3-18-11(16)13(14,12(17)19-4-2)7-10-15-8-5-6-9-15/h5-6,8-9H,3-4,7,10H2,1-2H3