[(2S,3S)-1-azido-3-bromanyl-4-[(4-methoxyphenyl)methoxy]butan-2-yl] hydrogen sulfate

Systemtic Name: [(2S,3S)-1-azido-3-bromanyl-4-[(4-methoxyphenyl)methoxy]butan-2-yl] hydrogen sulfate Openeye Name: [(1S,2S)-1-(azidomethyl)-2-bromo-3-[(4-methoxyphenyl)methoxy]propyl] hydrogen sulfate CAS Name: sulfuric acid [(2S,3S)-1-azido-3-bromo-4-[(4-methoxyphenyl)methoxy]butan-2-yl] ester IUPAC Name: [(2S,3S)-1-azido-3-bromo-4-[(4-methoxyphenyl)methoxy]butan-2-yl] hydrogen sulfate Traditional Name: sulfuric acid [(1S,2S)-1-(azidomethyl)-2-bromo-3-p-anisyloxy-propyl] ester Formula: C12H16BrN3O6S MolecularWeight: 410.24094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COCC(C(CN=[N+]=[N-])OS(=O)(=O)O)Br

Isomeric SMILES

COC1=CC=C(C=C1)COC[C@@H]([C@H](CN=[N+]=[N-])OS(=O)(=O)O)Br

InChI

InChI=1S/C12H16BrN3O6S/c1-20-10-4-2-9(3-5-10)7-21-8-11(13)12(6-15-16-14)22-23(17,18)19/h2-5,11-12H,6-8H2,1H3,(H,17,18,19)/t11-,12-/m0/s1