N-(3-bromanyl-5-chloranyl-pyridin-2-yl)-4-nitro-N-pyridin-1-ium-1-yl-benzenesulfonamide chloride

Systemtic Name: N-(3-bromanyl-5-chloranyl-pyridin-2-yl)-4-nitro-N-pyridin-1-ium-1-yl-benzenesulfonamide chloride Openeye Name: N-(3-bromo-5-chloro-2-pyridyl)-4-nitro-N-pyridin-1-ium-1-yl-benzenesulfonamide chloride CAS Name: N-(3-bromo-5-chloro-2-pyridinyl)-4-nitro-N-(1-pyridin-1-iumyl)benzenesulfonamide chloride IUPAC Name: N-(3-bromo-5-chloropyridin-2-yl)-4-nitro-N-pyridin-1-ium-1-ylbenzenesulfonamide chloride Traditional Name: N-(3-bromo-5-chloro-2-pyridyl)-4-nitro-N-pyridin-1-ium-1-yl-benzenesulfonamide chloride Formula: C16H11BrCl2N4O4S MolecularWeight: 506.15794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)N(C2=C(C=C(C=N2)Cl)Br)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)N(C2=C(C=C(C=N2)Cl)Br)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C16H11BrClN4O4S.ClH/c17-15-10-12(18)11-19-16(15)21(20-8-2-1-3-9-20)27(25,26)14-6-4-13(5-7-14)22(23)24;/h1-11H;1H/q+1;/p-1