N-[3-[(2-chloranyl-4-nitro-phenyl)amino]-2,2-dimethyl-propyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(2-chloranyl-4-nitro-phenyl)amino]-2,2-dimethyl-propyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(2-chloro-4-nitro-anilino)-2,2-dimethyl-propyl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-(2-chloro-4-nitroanilino)-2,2-dimethylpropyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-(2-chloro-4-nitroanilino)-2,2-dimethylpropyl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-(2-chloro-4-nitro-anilino)-2,2-dimethyl-propyl]-4-fluoro-benzenesulfonamide Formula: C17H19ClFN3O4S MolecularWeight: 415.866863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=C(C=C1)[N+](=O)[O-])Cl)CNS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(CNC1=C(C=C(C=C1)[N+](=O)[O-])Cl)CNS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H19ClFN3O4S/c1-17(2,10-20-16-8-5-13(22(23)24)9-15(16)18)11-21-27(25,26)14-6-3-12(19)4-7-14/h3-9,20-21H,10-11H2,1-2H3