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

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]-naphthalen-1-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4-difluorophenyl)-(1-naphthyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,4-difluorophenyl)-(1-naphthalenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-difluorophenyl)-naphthalen-1-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,4-difluorophenyl)-(1-naphthyl)methyl]nipecotic acid Formula: C23H21F2NO2 MolecularWeight: 381.415146

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=C(C=C(C=C2)F)F)C3=CC=CC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=C(C=C(C=C2)F)F)C3=CC=CC4=CC=CC=C43)C(=O)O

InChI

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