tert-butyl 4-[[2-(3-fluorophenyl)pyridin-4-yl]methyl-(4-methoxyphenyl)amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(3-fluorophenyl)pyridin-4-yl]methyl-(4-methoxyphenyl)amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[N-[[2-(3-fluorophenyl)-4-pyridyl]methyl]-4-methoxy-anilino]piperidine-1-carboxylate CAS Name: 4-[N-[[2-(3-fluorophenyl)-4-pyridinyl]methyl]-4-methoxyanilino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[N-[[2-(3-fluorophenyl)pyridin-4-yl]methyl]-4-methoxyanilino]piperidine-1-carboxylate Traditional Name: 4-[N-[[2-(3-fluorophenyl)-4-pyridyl]methyl]-4-methoxy-anilino]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H34FN3O3 MolecularWeight: 491.596963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N(CC2=CC(=NC=C2)C3=CC(=CC=C3)F)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N(CC2=CC(=NC=C2)C3=CC(=CC=C3)F)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H34FN3O3/c1-29(2,3)36-28(34)32-16-13-25(14-17-32)33(24-8-10-26(35-4)11-9-24)20-21-12-15-31-27(18-21)22-6-5-7-23(30)19-22/h5-12,15,18-19,25H,13-14,16-17,20H2,1-4H3