diethyl 2-[(4-iodophenyl)sulfonylamino]propanedioate

Systemtic Name: diethyl 2-[(4-iodophenyl)sulfonylamino]propanedioate Openeye Name: diethyl 2-[(4-iodophenyl)sulfonylamino]propanedioate CAS Name: 2-[(4-iodophenyl)sulfonylamino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(4-iodophenyl)sulfonylamino]propanedioate Traditional Name: 2-[(4-iodophenyl)sulfonylamino]malonic acid diethyl ester Formula: C13H16INO6S MolecularWeight: 441.23871

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16INO6S/c1-3-20-12(16)11(13(17)21-4-2)15-22(18,19)10-7-5-9(14)6-8-10/h5-8,11,15H,3-4H2,1-2H3