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

Systemtic Name: 1-[(3-fluoranyl-4-methyl-phenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-fluoro-4-methyl-phenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-fluoro-4-methylphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-fluoro-4-methylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(3-fluoro-4-methyl-benzyl)nipecotic acid Formula: C14H18FNO2 MolecularWeight: 251.296623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)F

InChI

InChI=1S/C14H18FNO2/c1-10-4-5-11(7-13(10)15)8-16-6-2-3-12(9-16)14(17)18/h4-5,7,12H,2-3,6,8-9H2,1H3,(H,17,18)