tert-butyl (2S)-2-[[(6-chloranylpyridin-3-yl)-methyl-amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[(6-chloranylpyridin-3-yl)-methyl-amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[(6-chloro-3-pyridyl)-methyl-amino]methyl]piperidine-1-carboxylate CAS Name: (2S)-2-[[(6-chloro-3-pyridinyl)-methylamino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(6-chloropyridin-3-yl)-methylamino]methyl]piperidine-1-carboxylate Traditional Name: (2S)-2-[[(6-chloro-3-pyridyl)-methyl-amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H26ClN3O2 MolecularWeight: 339.86024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1CN(C)C2=CN=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C)C2=CN=C(C=C2)Cl

InChI

InChI=1S/C17H26ClN3O2/c1-17(2,3)23-16(22)21-10-6-5-7-14(21)12-20(4)13-8-9-15(18)19-11-13/h8-9,11,14H,5-7,10,12H2,1-4H3/t14-/m0/s1