[(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-isothiocyanato-5-phenylselanyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-isothiocyanato-5-phenylselanyl-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-3,4-diacetoxy-6-isothiocyanato-5-phenylselanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-isothiocyanato-5-(phenylseleno)-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-3,4-diacetyloxy-6-isothiocyanato-5-phenylselanyloxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-3,4-diacetoxy-6-isothiocyanato-5-(phenylseleno)tetrahydropyran-2-yl]methyl ester Formula: C19H21NO7SSe MolecularWeight: 486.39754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)N=C=S)[Se]C2=CC=CC=C2)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)N=C=S)[Se]C2=CC=CC=C2)OC(=O)C)OC(=O)C

InChI

InChI=1S/C19H21NO7SSe/c1-11(21)24-9-15-16(25-12(2)22)17(26-13(3)23)18(19(27-15)20-10-28)29-14-7-5-4-6-8-14/h4-8,15-19H,9H2,1-3H3/t15-,16-,17+,18-,19-/m1/s1