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

Systemtic Name: 1-[3-(3-bromanylphenoxy)propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-(3-bromophenoxy)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-(3-bromophenoxy)-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(3-bromophenoxy)propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(3-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(=CC=C2)Br

Isomeric SMILES

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

InChI

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