5-azanyl-2-bromanyl-benzenesulfonic acid

Systemtic Name: 5-azanyl-2-bromanyl-benzenesulfonic acid Openeye Name: 5-amino-2-bromo-benzenesulfonic acid CAS Name: 5-amino-2-bromobenzenesulfonic acid IUPAC Name: 5-amino-2-bromobenzenesulfonic acid Traditional Name: 5-amino-2-bromo-besylic acid Formula: C6H6BrNO3S MolecularWeight: 252.08574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)O)Br

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)O)Br

InChI

InChI=1S/C6H6BrNO3S/c7-5-2-1-4(8)3-6(5)12(9,10)11/h1-3H,8H2,(H,9,10,11)