3-[(5-bromanyl-4-nitro-1H-imidazol-2-yl)sulfanyl]propanoic acid

Systemtic Name: 3-[(5-bromanyl-4-nitro-1H-imidazol-2-yl)sulfanyl]propanoic acid Openeye Name: 3-[(5-bromo-4-nitro-1H-imidazol-2-yl)sulfanyl]propanoic acid CAS Name: 3-[(5-bromo-4-nitro-1H-imidazol-2-yl)thio]propanoic acid IUPAC Name: 3-[(5-bromo-4-nitro-1H-imidazol-2-yl)sulfanyl]propanoic acid Traditional Name: 3-[(5-bromo-4-nitro-1H-imidazol-2-yl)thio]propionic acid Formula: C6H6BrN3O4S MolecularWeight: 296.09854

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Descriptors Computed from Structure

Canonical SMILES:

C(CSC1=NC(=C(N1)Br)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C(CSC1=NC(=C(N1)Br)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C6H6BrN3O4S/c7-4-5(10(13)14)9-6(8-4)15-2-1-3(11)12/h1-2H2,(H,8,9)(H,11,12)