1-(2-bromophenyl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(2-bromophenyl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(2-bromobenzoyl)piperidine-4-carboxylic acid CAS Name: 1-[(2-bromophenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2-bromobenzoyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-bromobenzoyl)isonipecotic acid Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CC=CC=C2Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C13H14BrNO3/c14-11-4-2-1-3-10(11)12(16)15-7-5-9(6-8-15)13(17)18/h1-4,9H,5-8H2,(H,17,18)