N-[bis(chloranyl)-fluoranyl-methyl]sulfanyl-N-butyl-4-nitro-benzenesulfonamide

Systemtic Name: N-[bis(chloranyl)-fluoranyl-methyl]sulfanyl-N-butyl-4-nitro-benzenesulfonamide Openeye Name: N-butyl-N-[dichloro(fluoro)methyl]sulfanyl-4-nitro-benzenesulfonamide CAS Name: N-butyl-N-[[dichloro(fluoro)methyl]thio]-4-nitrobenzenesulfonamide IUPAC Name: N-butyl-N-[dichloro(fluoro)methyl]sulfanyl-4-nitrobenzenesulfonamide Traditional Name: N-butyl-N-[[dichloro(fluoro)methyl]thio]-4-nitro-benzenesulfonamide Formula: C11H13Cl2FN2O4S2 MolecularWeight: 391.266323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(SC(F)(Cl)Cl)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCN(SC(F)(Cl)Cl)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H13Cl2FN2O4S2/c1-2-3-8-15(21-11(12,13)14)22(19,20)10-6-4-9(5-7-10)16(17)18/h4-7H,2-3,8H2,1H3