bromanylzinc(1+); methyl (2S,3R,5R)-3-methanidyl-5-methyl-1-(phenylmethyl)piperidine-2-carboxylate

Systemtic Name: bromanylzinc(1+); methyl (2S,3R,5R)-3-methanidyl-5-methyl-1-(phenylmethyl)piperidine-2-carboxylate Openeye Name: bromozinc(1+); methyl (2S,3R,5R)-1-benzyl-3-methanidyl-5-methyl-piperidine-2-carboxylate CAS Name: bromozinc(1+); (2S,3R,5R)-3-methanidyl-5-methyl-1-(phenylmethyl)-2-piperidinecarboxylic acid methyl ester IUPAC Name: bromozinc(1+); methyl (2S,3R,5R)-1-benzyl-3-methanidyl-5-methylpiperidine-2-carboxylate Traditional Name: (2S,3R,5R)-1-benzyl-3-methanidyl-5-methyl-pipecolinic acid methyl ester; bromozinc(1+) Formula: C16H22BrNO2Zn MolecularWeight: 405.66438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(N(C1)CC2=CC=CC=C2)C(=O)OC)[CH2-].[Zn+]Br

Isomeric SMILES

C[C@@H]1C[C@H]([C@H](N(C1)CC2=CC=CC=C2)C(=O)OC)[CH2-].[Zn+]Br

InChI

InChI=1S/C16H22NO2.BrH.Zn/c1-12-9-13(2)15(16(18)19-3)17(10-12)11-14-7-5-4-6-8-14;;/h4-8,12-13,15H,2,9-11H2,1,3H3;1H;/q-1;;+2/p-1/t12-,13-,15+;;/m1../s1