4-bromanyl-3-cyclohexylsulfonyl-benzoic acid

Systemtic Name: 4-bromanyl-3-cyclohexylsulfonyl-benzoic acid Openeye Name: 4-bromo-3-cyclohexylsulfonyl-benzoic acid CAS Name: 4-bromo-3-cyclohexylsulfonylbenzoic acid IUPAC Name: 4-bromo-3-cyclohexylsulfonylbenzoic acid Traditional Name: 4-bromo-3-cyclohexylsulfonyl-benzoic acid Formula: C13H15BrO4S MolecularWeight: 347.2248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

Isomeric SMILES

C1CCC(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

InChI

InChI=1S/C13H15BrO4S/c14-11-7-6-9(13(15)16)8-12(11)19(17,18)10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,15,16)