tert-butyl N-[1-[(6-bromanylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(6-bromanylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]carbamate Openeye Name: tert-butyl N-[1-[(6-bromo-2-pyridyl)methyl]piperidin-1-ium-4-yl]carbamate CAS Name: N-[1-[(6-bromo-2-pyridinyl)methyl]-4-piperidin-1-iumyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(6-bromopyridin-2-yl)methyl]piperidin-1-ium-4-yl]carbamate Traditional Name: N-[1-[(6-bromo-2-pyridyl)methyl]piperidin-1-ium-4-yl]carbamic acid tert-butyl ester Formula: C16H25BrN3O2+ MolecularWeight: 371.2926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC[NH+](CC1)CC2=NC(=CC=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)NC1CC[NH+](CC1)CC2=NC(=CC=C2)Br

InChI

InChI=1S/C16H24BrN3O2/c1-16(2,3)22-15(21)19-12-7-9-20(10-8-12)11-13-5-4-6-14(17)18-13/h4-6,12H,7-11H2,1-3H3,(H,19,21)/p+1