4-bromanyl-3-piperidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 4-bromanyl-3-piperidin-1-ylsulfonyl-benzoic acid Openeye Name: 4-bromo-3-(1-piperidylsulfonyl)benzoic acid CAS Name: 4-bromo-3-(1-piperidinylsulfonyl)benzoic acid IUPAC Name: 4-bromo-3-piperidin-1-ylsulfonylbenzoic acid Traditional Name: 4-bromo-3-piperidinosulfonyl-benzoic acid Formula: C12H14BrNO4S MolecularWeight: 348.21286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Br

InChI

InChI=1S/C12H14BrNO4S/c13-10-5-4-9(12(15)16)8-11(10)19(17,18)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H,15,16)