tert-butyl (2R)-2-[2-(3-bromophenyl)-1,2,3,4-tetrazol-5-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-[2-(3-bromophenyl)-1,2,3,4-tetrazol-5-yl]piperidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-[2-(3-bromophenyl)tetrazol-5-yl]piperidine-1-carboxylate CAS Name: (2R)-2-[2-(3-bromophenyl)-5-tetrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[2-(3-bromophenyl)tetrazol-5-yl]piperidine-1-carboxylate Traditional Name: (2R)-2-[2-(3-bromophenyl)tetrazol-5-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H22BrN5O2 MolecularWeight: 408.29288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1C2=NN(N=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC[C@@H]1C2=NN(N=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H22BrN5O2/c1-17(2,3)25-16(24)22-10-5-4-9-14(22)15-19-21-23(20-15)13-8-6-7-12(18)11-13/h6-8,11,14H,4-5,9-10H2,1-3H3/t14-/m1/s1