(2S,3R)-2,3-bis(bromanyl)-3-(4-sulfamoylphenyl)propanoate

Systemtic Name: (2S,3R)-2,3-bis(bromanyl)-3-(4-sulfamoylphenyl)propanoate Openeye Name: (2S,3R)-2,3-dibromo-3-(4-sulfamoylphenyl)propanoate CAS Name: (2S,3R)-2,3-dibromo-3-(4-sulfamoylphenyl)propanoate IUPAC Name: (2S,3R)-2,3-dibromo-3-(4-sulfamoylphenyl)propanoate Traditional Name: (2S,3R)-2,3-dibromo-3-(4-sulfamoylphenyl)propionate Formula: C9H8Br2NO4S- MolecularWeight: 386.03712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C(C(=O)[O-])Br)Br)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1[C@H]([C@H](C(=O)[O-])Br)Br)S(=O)(=O)N

InChI

InChI=1S/C9H9Br2NO4S/c10-7(8(11)9(13)14)5-1-3-6(4-2-5)17(12,15)16/h1-4,7-8H,(H,13,14)(H2,12,15,16)/p-1/t7-,8-/m1/s1