[(2S,3R,4S,5S,6R)-4-azido-6-(hydroxymethyl)-5-oxidanyl-2-phenylsulfanyl-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3R,4S,5S,6R)-4-azido-6-(hydroxymethyl)-5-oxidanyl-2-phenylsulfanyl-oxan-3-yl] ethanoate Openeye Name: [(2S,3R,4S,5S,6R)-4-azido-5-hydroxy-6-(hydroxymethyl)-2-phenylsulfanyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3R,4S,5S,6R)-4-azido-5-hydroxy-6-(hydroxymethyl)-2-(phenylthio)-3-oxanyl] ester IUPAC Name: [(2S,3R,4S,5S,6R)-4-azido-5-hydroxy-6-(hydroxymethyl)-2-phenylsulfanyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3R,4S,5S,6R)-4-azido-5-hydroxy-6-methylol-2-(phenylthio)tetrahydropyran-3-yl] ester Formula: C14H17N3O5S MolecularWeight: 339.36688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(C(OC1SC2=CC=CC=C2)CO)O)N=[N+]=[N-]

Isomeric SMILES

CC(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1SC2=CC=CC=C2)CO)O)N=[N+]=[N-]

InChI

InChI=1S/C14H17N3O5S/c1-8(19)21-13-11(16-17-15)12(20)10(7-18)22-14(13)23-9-5-3-2-4-6-9/h2-6,10-14,18,20H,7H2,1H3/t10-,11+,12-,13-,14+/m1/s1