1-[3-(3-bromophenyl)propanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[3-(3-bromophenyl)propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-(3-bromophenyl)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-(3-bromophenyl)-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(3-bromophenyl)propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(3-bromophenyl)propanoyl]isonipecotic acid Formula: C15H18BrNO3 MolecularWeight: 340.21232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CCC2=CC(=CC=C2)Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CCC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H18BrNO3/c16-13-3-1-2-11(10-13)4-5-14(18)17-8-6-12(7-9-17)15(19)20/h1-3,10,12H,4-9H2,(H,19,20)