2-bromanyl-5-cyclopentylsulfonyl-benzoic acid

Systemtic Name: 2-bromanyl-5-cyclopentylsulfonyl-benzoic acid Openeye Name: 2-bromo-5-cyclopentylsulfonyl-benzoic acid CAS Name: 2-bromo-5-cyclopentylsulfonylbenzoic acid IUPAC Name: 2-bromo-5-cyclopentylsulfonylbenzoic acid Traditional Name: 2-bromo-5-cyclopentylsulfonyl-benzoic acid Formula: C12H13BrO4S MolecularWeight: 333.19822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CCC(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C12H13BrO4S/c13-11-6-5-9(7-10(11)12(14)15)18(16,17)8-3-1-2-4-8/h5-8H,1-4H2,(H,14,15)