4-[[[2,5-bis(bromanyl)thiophen-3-yl]sulfonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[2,5-bis(bromanyl)thiophen-3-yl]sulfonylamino]methyl]benzoic acid Openeye Name: 4-[[(2,5-dibromo-3-thienyl)sulfonylamino]methyl]benzoic acid CAS Name: 4-[[(2,5-dibromo-3-thiophenyl)sulfonylamino]methyl]benzoic acid IUPAC Name: 4-[[(2,5-dibromothiophen-3-yl)sulfonylamino]methyl]benzoic acid Traditional Name: 4-[[(2,5-dibromo-3-thienyl)sulfonylamino]methyl]benzoic acid Formula: C12H9Br2NO4S2 MolecularWeight: 455.14216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNS(=O)(=O)C2=C(SC(=C2)Br)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNS(=O)(=O)C2=C(SC(=C2)Br)Br)C(=O)O

InChI

InChI=1S/C12H9Br2NO4S2/c13-10-5-9(11(14)20-10)21(18,19)15-6-7-1-3-8(4-2-7)12(16)17/h1-5,15H,6H2,(H,16,17)