tert-butyl 4-[(1S)-1-(6-chloranylpyrazin-2-yl)-2-oxidanyl-ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1S)-1-(6-chloranylpyrazin-2-yl)-2-oxidanyl-ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(1S)-1-(6-chloropyrazin-2-yl)-2-hydroxy-ethyl]piperidine-1-carboxylate CAS Name: 4-[(1S)-1-(6-chloro-2-pyrazinyl)-2-hydroxyethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1S)-1-(6-chloropyrazin-2-yl)-2-hydroxyethyl]piperidine-1-carboxylate Traditional Name: 4-[(1S)-1-(6-chloropyrazin-2-yl)-2-hydroxy-ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C16H24ClN3O3 MolecularWeight: 341.83306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(CO)C2=CN=CC(=N2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)[C@H](CO)C2=CN=CC(=N2)Cl

InChI

InChI=1S/C16H24ClN3O3/c1-16(2,3)23-15(22)20-6-4-11(5-7-20)12(10-21)13-8-18-9-14(17)19-13/h8-9,11-12,21H,4-7,10H2,1-3H3/t12-/m0/s1