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

Systemtic Name: 1-[3-(4-bromanylphenoxy)propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-(4-bromophenoxy)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-(4-bromophenoxy)-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(4-bromophenoxy)propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(4-bromophenoxy)propanoyl]isonipecotic acid Formula: C15H18BrNO4 MolecularWeight: 356.21172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CCOC2=CC=C(C=C2)Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H18BrNO4/c16-12-1-3-13(4-2-12)21-10-7-14(18)17-8-5-11(6-9-17)15(19)20/h1-4,11H,5-10H2,(H,19,20)