1-[(4-cyano-2-fluoranyl-phenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-cyano-2-fluoranyl-phenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-cyano-2-fluoro-phenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-cyano-2-fluorophenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-cyano-2-fluorophenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(4-cyano-2-fluoro-benzyl)nipecotic acid Formula: C14H15FN2O2 MolecularWeight: 262.279503

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C(C=C(C=C2)C#N)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC2=C(C=C(C=C2)C#N)F)C(=O)O

InChI

InChI=1S/C14H15FN2O2/c15-13-6-10(7-16)3-4-11(13)8-17-5-1-2-12(9-17)14(18)19/h3-4,6,12H,1-2,5,8-9H2,(H,18,19)