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

Systemtic Name: 2-(3-bromanyl-4-methylsulfanyl-phenyl)-3-cyclopentyl-propanoic acid Openeye Name: 2-(3-bromo-4-methylsulfanyl-phenyl)-3-cyclopentyl-propanoic acid CAS Name: 2-[3-bromo-4-(methylthio)phenyl]-3-cyclopentylpropanoic acid IUPAC Name: 2-(3-bromo-4-methylsulfanylphenyl)-3-cyclopentylpropanoic acid Traditional Name: 2-[3-bromo-4-(methylthio)phenyl]-3-cyclopentyl-propionic acid Formula: C15H19BrO2S MolecularWeight: 343.27916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(CC2CCCC2)C(=O)O)Br

Isomeric SMILES

CSC1=C(C=C(C=C1)C(CC2CCCC2)C(=O)O)Br

InChI

InChI=1S/C15H19BrO2S/c1-19-14-7-6-11(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)