1-[[2,4-bis(fluoranyl)phenyl]-naphthalen-1-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]-naphthalen-1-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,4-difluorophenyl)-(1-naphthyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,4-difluorophenyl)-(1-naphthalenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-difluorophenyl)-naphthalen-1-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2,4-difluorophenyl)-(1-naphthyl)methyl]isonipecotic acid Formula: C23H21F2NO2 MolecularWeight: 381.415146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=C(C=C(C=C2)F)F)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=C(C=C(C=C2)F)F)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H21F2NO2/c24-17-8-9-20(21(25)14-17)22(26-12-10-16(11-13-26)23(27)28)19-7-3-5-15-4-1-2-6-18(15)19/h1-9,14,16,22H,10-13H2,(H,27,28)