1-[2,4-bis(bromanyl)-6-nitro-3-oxidanyl-phenyl]ethanesulfonic acid

Systemtic Name: 1-[2,4-bis(bromanyl)-6-nitro-3-oxidanyl-phenyl]ethanesulfonic acid Openeye Name: 1-(2,4-dibromo-3-hydroxy-6-nitro-phenyl)ethanesulfonic acid CAS Name: 1-(2,4-dibromo-3-hydroxy-6-nitrophenyl)ethanesulfonic acid IUPAC Name: 1-(2,4-dibromo-3-hydroxy-6-nitrophenyl)ethanesulfonic acid Traditional Name: 1-(2,4-dibromo-3-hydroxy-6-nitro-phenyl)ethanesulfonic acid Formula: C8H7Br2NO6S MolecularWeight: 405.01728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7Br2NO6S/c1-3(18(15,16)17)6-5(11(13)14)2-4(9)8(12)7(6)10/h2-3,12H,1H3,(H,15,16,17)