[(2R,3S,4R,5R,6S)-5-azido-4-phenylmethoxy-2-(phenylmethoxymethyl)-6-thiocyanato-oxan-3-yl] ethanoate

Systemtic Name: [(2R,3S,4R,5R,6S)-5-azido-4-phenylmethoxy-2-(phenylmethoxymethyl)-6-thiocyanato-oxan-3-yl] ethanoate Openeye Name: [(2R,3S,4R,5R,6S)-5-azido-4-benzyloxy-2-(benzyloxymethyl)-6-thiocyanato-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2R,3S,4R,5R,6S)-5-azido-4-phenylmethoxy-2-(phenylmethoxymethyl)-6-thiocyanato-3-oxanyl] ester IUPAC Name: [(2R,3S,4R,5R,6S)-5-azido-4-phenylmethoxy-2-(phenylmethoxymethyl)-6-thiocyanatooxan-3-yl] acetate Traditional Name: acetic acid [(2R,3S,4R,5R,6S)-5-azido-4-benzoxy-2-(benzoxymethyl)-6-thiocyanato-tetrahydropyran-3-yl] ester Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C(C1OCC2=CC=CC=C2)N=[N+]=[N-])SC#N)COCC3=CC=CC=C3

Isomeric SMILES

CC(=O)O[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1OCC2=CC=CC=C2)N=[N+]=[N-])SC#N)COCC3=CC=CC=C3

InChI

InChI=1S/C23H24N4O5S/c1-16(28)31-21-19(14-29-12-17-8-4-2-5-9-17)32-23(33-15-24)20(26-27-25)22(21)30-13-18-10-6-3-7-11-18/h2-11,19-23H,12-14H2,1H3/t19-,20-,21-,22-,23+/m1/s1