3-chloranyl-N-(4-fluoranyl-3-nitro-phenyl)-4-methyl-5-nitro-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-(4-fluoranyl-3-nitro-phenyl)-4-methyl-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-(4-fluoro-3-nitro-phenyl)-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-(4-fluoro-3-nitrophenyl)-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-(4-fluoro-3-nitrophenyl)-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-(4-fluoro-3-nitro-phenyl)-4-methyl-5-nitro-benzenesulfonamide Formula: C13H9ClFN3O6S MolecularWeight: 389.743463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H9ClFN3O6S/c1-7-10(14)5-9(6-12(7)17(19)20)25(23,24)16-8-2-3-11(15)13(4-8)18(21)22/h2-6,16H,1H3