1-[3-[3,4-bis(fluoranyl)phenyl]propanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-[3,4-bis(fluoranyl)phenyl]propanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(3,4-difluorophenyl)propanoyl]piperidine-3-carboxylic acid CAS Name: 1-[3-(3,4-difluorophenyl)-1-oxopropyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(3,4-difluorophenyl)propanoyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(3,4-difluorophenyl)propanoyl]nipecotic acid Formula: C15H17F2NO3 MolecularWeight: 297.297186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=CC(=C(C=C2)F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CCC2=CC(=C(C=C2)F)F)C(=O)O

InChI

InChI=1S/C15H17F2NO3/c16-12-5-3-10(8-13(12)17)4-6-14(19)18-7-1-2-11(9-18)15(20)21/h3,5,8,11H,1-2,4,6-7,9H2,(H,20,21)