2-tert-butyl-4-[[3-fluoranyl-2-[(4-methylphenyl)methyl]phenyl]amino]piperidine-1-carboxylic acid

Systemtic Name: 2-tert-butyl-4-[[3-fluoranyl-2-[(4-methylphenyl)methyl]phenyl]amino]piperidine-1-carboxylic acid Openeye Name: 2-tert-butyl-4-[3-fluoro-2-(p-tolylmethyl)anilino]piperidine-1-carboxylic acid CAS Name: 2-tert-butyl-4-[3-fluoro-2-[(4-methylphenyl)methyl]anilino]-1-piperidinecarboxylic acid IUPAC Name: 2-tert-butyl-4-[3-fluoro-2-[(4-methylphenyl)methyl]anilino]piperidine-1-carboxylic acid Traditional Name: 2-tert-butyl-4-[3-fluoro-2-(4-methylbenzyl)anilino]piperidine-1-carboxylic acid Formula: C24H31FN2O2 MolecularWeight: 398.513543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C(C=CC=C2F)NC3CCN(C(C3)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C(C=CC=C2F)NC3CCN(C(C3)C(C)(C)C)C(=O)O

InChI

InChI=1S/C24H31FN2O2/c1-16-8-10-17(11-9-16)14-19-20(25)6-5-7-21(19)26-18-12-13-27(23(28)29)22(15-18)24(2,3)4/h5-11,18,22,26H,12-15H2,1-4H3,(H,28,29)