[(2R,3S,4S,5R)-4-azido-5-methoxy-3-(phenylcarbonyloxy)thiolan-2-yl]methyl benzoate

Systemtic Name: [(2R,3S,4S,5R)-4-azido-5-methoxy-3-(phenylcarbonyloxy)thiolan-2-yl]methyl benzoate Openeye Name: [(2R,3S,4S,5R)-4-azido-3-benzoyloxy-5-methoxy-tetrahydrothiophen-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3S,4S,5R)-4-azido-3-benzoyloxy-5-methoxy-2-thiolanyl]methyl ester IUPAC Name: [(2R,3S,4S,5R)-4-azido-3-benzoyloxy-5-methoxythiolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3S,4S,5R)-4-azido-3-benzoyloxy-5-methoxy-tetrahydrothiophen-2-yl]methyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(S1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)N=[N+]=[N-]

Isomeric SMILES

CO[C@H]1[C@H]([C@@H]([C@H](S1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)N=[N+]=[N-]

InChI

InChI=1S/C20H19N3O5S/c1-26-20-16(22-23-21)17(28-19(25)14-10-6-3-7-11-14)15(29-20)12-27-18(24)13-8-4-2-5-9-13/h2-11,15-17,20H,12H2,1H3/t15-,16+,17-,20-/m1/s1