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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)S(=O)(=O)C2=C(SC(=C2)Br)Br

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)S(=O)(=O)C2=C(SC(=C2)Br)Br

InChI

InChI=1S/C12H9Br2NO4S2/c1-15(8-5-3-2-4-7(8)12(16)17)21(18,19)9-6-10(13)20-11(9)14/h2-6H,1H3,(H,16,17)