6-bromanyl-4-nitro-5-oxidanyl-1,3-benzoxathiol-2-one

Systemtic Name: 6-bromanyl-4-nitro-5-oxidanyl-1,3-benzoxathiol-2-one Openeye Name: 6-bromo-5-hydroxy-4-nitro-1,3-benzoxathiol-2-one CAS Name: 6-bromo-5-hydroxy-4-nitro-1,3-benzoxathiol-2-one IUPAC Name: 6-bromo-5-hydroxy-4-nitro-1,3-benzoxathiol-2-one Traditional Name: 6-bromo-5-hydroxy-4-nitro-1,3-benzoxathiol-2-one Formula: C7H2BrNO5S MolecularWeight: 292.06348

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=C(C(=C1Br)O)[N+](=O)[O-])SC(=O)O2

Isomeric SMILES

C1=C2C(=C(C(=C1Br)O)[N+](=O)[O-])SC(=O)O2

InChI

InChI=1S/C7H2BrNO5S/c8-2-1-3-6(15-7(11)14-3)4(5(2)10)9(12)13/h1,10H