azanyl-(5-bromanylpyridin-3-yl)carbonyl-tert-butyl-(4-chlorophenyl)carbonyl-azanium

Systemtic Name: azanyl-(5-bromanylpyridin-3-yl)carbonyl-tert-butyl-(4-chlorophenyl)carbonyl-azanium Openeye Name: amino-(5-bromopyridine-3-carbonyl)-tert-butyl-(4-chlorobenzoyl)ammonium CAS Name: amino-[(5-bromo-3-pyridinyl)-oxomethyl]-tert-butyl-[(4-chlorophenyl)-oxomethyl]ammonium IUPAC Name: amino-(5-bromopyridine-3-carbonyl)-tert-butyl-(4-chlorobenzoyl)azanium Traditional Name: amino-(5-bromonicotinoyl)-tert-butyl-(4-chlorobenzoyl)ammonium Formula: C17H18BrClN3O2+ MolecularWeight: 411.70072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+](C(=O)C1=CC=C(C=C1)Cl)(C(=O)C2=CC(=CN=C2)Br)N

Isomeric SMILES

CC(C)(C)[N+](C(=O)C1=CC=C(C=C1)Cl)(C(=O)C2=CC(=CN=C2)Br)N

InChI

InChI=1S/C17H18BrClN3O2/c1-17(2,3)22(20,15(23)11-4-6-14(19)7-5-11)16(24)12-8-13(18)10-21-9-12/h4-10H,20H2,1-3H3/q+1