2-(3-bromanyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanoic acid

Systemtic Name: 2-(3-bromanyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanoic acid Openeye Name: 2-(3-bromo-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanoic acid CAS Name: 2-(3-bromo-4-methylsulfonylphenyl)-3-cyclopentylpropanoic acid IUPAC Name: 2-(3-bromo-4-methylsulfonylphenyl)-3-cyclopentylpropanoic acid Traditional Name: 2-(3-bromo-4-mesyl-phenyl)-3-cyclopentyl-propionic acid Formula: C15H19BrO4S MolecularWeight: 375.27796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)O)Br

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)O)Br

InChI

InChI=1S/C15H19BrO4S/c1-21(19,20)14-7-6-11(9-13(14)16)12(15(17)18)8-10-4-2-3-5-10/h6-7,9-10,12H,2-5,8H2,1H3,(H,17,18)