1-(3-bromophenyl)sulfonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(3-bromophenyl)sulfonylpiperidine-3-carboxylic acid Openeye Name: 1-(3-bromophenyl)sulfonylpiperidine-3-carboxylic acid CAS Name: 1-(3-bromophenyl)sulfonyl-3-piperidinecarboxylic acid IUPAC Name: 1-(3-bromophenyl)sulfonylpiperidine-3-carboxylic acid Traditional Name: 1-(3-bromophenyl)sulfonylnipecotic acid Formula: C12H14BrNO4S MolecularWeight: 348.21286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC(=CC=C2)Br)C(=O)O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC(=CC=C2)Br)C(=O)O

InChI

InChI=1S/C12H14BrNO4S/c13-10-4-1-5-11(7-10)19(17,18)14-6-2-3-9(8-14)12(15)16/h1,4-5,7,9H,2-3,6,8H2,(H,15,16)