1-[1-[2,4-bis(fluoranyl)phenyl]pentyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[1-[2,4-bis(fluoranyl)phenyl]pentyl]piperidine-3-carboxylic acid Openeye Name: 1-[1-(2,4-difluorophenyl)pentyl]piperidine-3-carboxylic acid CAS Name: 1-[1-(2,4-difluorophenyl)pentyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[1-(2,4-difluorophenyl)pentyl]piperidine-3-carboxylic acid Traditional Name: 1-[1-(2,4-difluorophenyl)pentyl]nipecotic acid Formula: C17H23F2NO2 MolecularWeight: 311.366826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(C=C(C=C1)F)F)N2CCCC(C2)C(=O)O

Isomeric SMILES

CCCCC(C1=C(C=C(C=C1)F)F)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C17H23F2NO2/c1-2-3-6-16(14-8-7-13(18)10-15(14)19)20-9-4-5-12(11-20)17(21)22/h7-8,10,12,16H,2-6,9,11H2,1H3,(H,21,22)