5-bromanyl-4-[2-(2-hydroxyethyl)piperidin-1-yl]sulfonyl-thiophene-2-carboxylic acid

Systemtic Name: 5-bromanyl-4-[2-(2-hydroxyethyl)piperidin-1-yl]sulfonyl-thiophene-2-carboxylic acid Openeye Name: 5-bromo-4-[[2-(2-hydroxyethyl)-1-piperidyl]sulfonyl]thiophene-2-carboxylic acid CAS Name: 5-bromo-4-[[2-(2-hydroxyethyl)-1-piperidinyl]sulfonyl]-2-thiophenecarboxylic acid IUPAC Name: 5-bromo-4-[2-(2-hydroxyethyl)piperidin-1-yl]sulfonylthiophene-2-carboxylic acid Traditional Name: 5-bromo-4-[2-(2-hydroxyethyl)piperidino]sulfonyl-2-thenoic acid Formula: C12H16BrNO5S2 MolecularWeight: 398.29314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCO)S(=O)(=O)C2=C(SC(=C2)C(=O)O)Br

Isomeric SMILES

C1CCN(C(C1)CCO)S(=O)(=O)C2=C(SC(=C2)C(=O)O)Br

InChI

InChI=1S/C12H16BrNO5S2/c13-11-10(7-9(20-11)12(16)17)21(18,19)14-5-2-1-3-8(14)4-6-15/h7-8,15H,1-6H2,(H,16,17)