[(3S,4R,5R)-3-acetamido-4-acetyloxy-5-[(E)-3-iodanylprop-2-enyl]-2-oxidanylidene-oxolan-3-yl]methyl ethanoate

Systemtic Name: [(3S,4R,5R)-3-acetamido-4-acetyloxy-5-[(E)-3-iodanylprop-2-enyl]-2-oxidanylidene-oxolan-3-yl]methyl ethanoate Openeye Name: [(3S,4R,5R)-3-acetamido-4-acetoxy-5-[(E)-3-iodoallyl]-2-oxo-tetrahydrofuran-3-yl]methyl acetate CAS Name: acetic acid [(3S,4R,5R)-3-acetamido-4-acetyloxy-5-[(E)-3-iodoprop-2-enyl]-2-oxo-3-oxolanyl]methyl ester IUPAC Name: [(3S,4R,5R)-3-acetamido-4-acetyloxy-5-[(E)-3-iodoprop-2-enyl]-2-oxooxolan-3-yl]methyl acetate Traditional Name: acetic acid [(3S,4R,5R)-3-acetamido-4-acetoxy-5-[(E)-3-iodoallyl]-2-keto-tetrahydrofuran-3-yl]methyl ester Formula: C14H18INO7 MolecularWeight: 439.19969

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C(C(OC1=O)CC=CI)OC(=O)C)COC(=O)C

Isomeric SMILES

CC(=O)N[C@]1([C@H]([C@H](OC1=O)C/C=C/I)OC(=O)C)COC(=O)C

InChI

InChI=1S/C14H18INO7/c1-8(17)16-14(7-21-9(2)18)12(22-10(3)19)11(5-4-6-15)23-13(14)20/h4,6,11-12H,5,7H2,1-3H3,(H,16,17)/b6-4+/t11-,12+,14+/m1/s1