tert-butyl 4-[(4-chlorophenyl)methyl-(3-fluorophenyl)amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-chlorophenyl)methyl-(3-fluorophenyl)amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[N-[(4-chlorophenyl)methyl]-3-fluoro-anilino]piperidine-1-carboxylate CAS Name: 4-[N-[(4-chlorophenyl)methyl]-3-fluoroanilino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[N-[(4-chlorophenyl)methyl]-3-fluoroanilino]piperidine-1-carboxylate Traditional Name: 4-(N-(4-chlorobenzyl)-3-fluoro-anilino)piperidine-1-carboxylic acid tert-butyl ester Formula: C23H28ClFN2O2 MolecularWeight: 418.932023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N(CC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N(CC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)F

InChI

InChI=1S/C23H28ClFN2O2/c1-23(2,3)29-22(28)26-13-11-20(12-14-26)27(21-6-4-5-19(25)15-21)16-17-7-9-18(24)10-8-17/h4-10,15,20H,11-14,16H2,1-3H3