tert-butyl 4-(6-bromanyl-5-chloranyl-pyridin-3-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-bromanyl-5-chloranyl-pyridin-3-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-bromo-5-chloro-3-pyridyl)piperazine-1-carboxylate CAS Name: 4-(6-bromo-5-chloro-3-pyridinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-bromo-5-chloropyridin-3-yl)piperazine-1-carboxylate Traditional Name: 4-(6-bromo-5-chloro-3-pyridyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C14H19BrClN3O2 MolecularWeight: 376.67656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=C(N=C2)Br)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=C(N=C2)Br)Cl

InChI

InChI=1S/C14H19BrClN3O2/c1-14(2,3)21-13(20)19-6-4-18(5-7-19)10-8-11(16)12(15)17-9-10/h8-9H,4-7H2,1-3H3