ethyl 4-(4-ethoxy-3-iodanyl-4-oxidanylidene-butyl)sulfanylbenzoate

Systemtic Name: ethyl 4-(4-ethoxy-3-iodanyl-4-oxidanylidene-butyl)sulfanylbenzoate Openeye Name: ethyl 4-(4-ethoxy-3-iodo-4-oxo-butyl)sulfanylbenzoate CAS Name: 4-[(4-ethoxy-3-iodo-4-oxobutyl)thio]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxy-3-iodo-4-oxobutyl)sulfanylbenzoate Traditional Name: 4-[(4-ethoxy-3-iodo-4-keto-butyl)thio]benzoic acid ethyl ester Formula: C15H19IO4S MolecularWeight: 422.27843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19IO4S/c1-3-19-14(17)11-5-7-12(8-6-11)21-10-9-13(16)15(18)20-4-2/h5-8,13H,3-4,9-10H2,1-2H3