1-methyl-2-[tris(bromanyl)methylsulfonyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-methyl-2-[tris(bromanyl)methylsulfonyl]benzimidazole-5-carboxylic acid Openeye Name: 1-methyl-2-(tribromomethylsulfonyl)benzimidazole-5-carboxylic acid CAS Name: 1-methyl-2-(tribromomethylsulfonyl)-5-benzimidazolecarboxylic acid IUPAC Name: 1-methyl-2-(tribromomethylsulfonyl)benzimidazole-5-carboxylic acid Traditional Name: 1-methyl-2-(tribromomethylsulfonyl)benzimidazole-5-carboxylic acid Formula: C10H7Br3N2O4S MolecularWeight: 490.95058

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)O)N=C1S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)O)N=C1S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C10H7Br3N2O4S/c1-15-7-3-2-5(8(16)17)4-6(7)14-9(15)20(18,19)10(11,12)13/h2-4H,1H3,(H,16,17)