tert-butyl 2-[(2S,3R,4R)-2-ethyl-4-iodanyl-5-oxidanylidene-oxolan-3-yl]-2-phenylsulfanyl-propanoate

Systemtic Name: tert-butyl 2-[(2S,3R,4R)-2-ethyl-4-iodanyl-5-oxidanylidene-oxolan-3-yl]-2-phenylsulfanyl-propanoate Openeye Name: tert-butyl 2-[(2S,3R,4R)-2-ethyl-4-iodo-5-oxo-tetrahydrofuran-3-yl]-2-phenylsulfanyl-propanoate CAS Name: 2-[(2S,3R,4R)-2-ethyl-4-iodo-5-oxo-3-oxolanyl]-2-(phenylthio)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2S,3R,4R)-2-ethyl-4-iodo-5-oxooxolan-3-yl]-2-phenylsulfanylpropanoate Traditional Name: 2-[(2S,3R,4R)-2-ethyl-4-iodo-5-keto-tetrahydrofuran-3-yl]-2-(phenylthio)propionic acid tert-butyl ester Formula: C19H25IO4S MolecularWeight: 476.36887

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(C(=O)O1)I)C(C)(C(=O)OC(C)(C)C)SC2=CC=CC=C2

Isomeric SMILES

CC[C@H]1[C@@H]([C@H](C(=O)O1)I)C(C)(C(=O)OC(C)(C)C)SC2=CC=CC=C2

InChI

InChI=1S/C19H25IO4S/c1-6-13-14(15(20)16(21)23-13)19(5,17(22)24-18(2,3)4)25-12-10-8-7-9-11-12/h7-11,13-15H,6H2,1-5H3/t13-,14-,15+,19?/m0/s1