N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-2-nitro-benzenesulfonamide Openeye Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-2-nitro-benzenesulfonamide CAS Name: N-[(3-chloro-4-fluorophenyl)methyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(3-chloro-4-fluorophenyl)methyl]-2-nitrobenzenesulfonamide Traditional Name: N-(3-chloro-4-fluoro-benzyl)-2-nitro-benzenesulfonamide Formula: C13H10ClFN2O4S MolecularWeight: 344.745903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H10ClFN2O4S/c14-10-7-9(5-6-11(10)15)8-16-22(20,21)13-4-2-1-3-12(13)17(18)19/h1-7,16H,8H2