1-[[2,4-bis(fluoranyl)phenyl]-(3,5-dimethylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]-(3,5-dimethylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,4-difluorophenyl)-(3,5-dimethylphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,4-difluorophenyl)-(3,5-dimethylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-difluorophenyl)-(3,5-dimethylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,4-difluorophenyl)-(3,5-dimethylphenyl)methyl]pipecolinic acid Formula: C21H23F2NO2 MolecularWeight: 359.409626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2=C(C=C(C=C2)F)F)N3CCCCC3C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(C2=C(C=C(C=C2)F)F)N3CCCCC3C(=O)O)C

InChI

InChI=1S/C21H23F2NO2/c1-13-9-14(2)11-15(10-13)20(17-7-6-16(22)12-18(17)23)24-8-4-3-5-19(24)21(25)26/h6-7,9-12,19-20H,3-5,8H2,1-2H3,(H,25,26)