diethyl 3-methyl-5-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[(2,3,5-triiodobenzoyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[oxo-(2,3,5-triiodophenyl)methyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(2,3,5-triiodobenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2,3,5-triiodobenzoyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H16I3NO5S MolecularWeight: 739.10175

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=CC(=C2I)I)I

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=CC(=C2I)I)I

InChI

InChI=1S/C18H16I3NO5S/c1-4-26-17(24)12-8(3)14(18(25)27-5-2)28-16(12)22-15(23)10-6-9(19)7-11(20)13(10)21/h6-7H,4-5H2,1-3H3,(H,22,23)