(2R,5S)-5-[(4-bromophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylate

Systemtic Name: (2R,5S)-5-[(4-bromophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylate Openeye Name: (2R,5S)-5-[(4-bromophenyl)methyl]-1-tert-butoxycarbonyl-piperidine-2-carboxylate CAS Name: (2R,5S)-5-[(4-bromophenyl)methyl]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-piperidinecarboxylate IUPAC Name: (2R,5S)-5-[(4-bromophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylate Traditional Name: (2R,5S)-5-(4-bromobenzyl)-1-tert-butoxycarbonyl-pipecolinate Formula: C18H23BrNO4- MolecularWeight: 397.28352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CCC1C(=O)[O-])CC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](CC[C@@H]1C(=O)[O-])CC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H24BrNO4/c1-18(2,3)24-17(23)20-11-13(6-9-15(20)16(21)22)10-12-4-7-14(19)8-5-12/h4-5,7-8,13,15H,6,9-11H2,1-3H3,(H,21,22)/p-1/t13-,15+/m0/s1