4-fluoranyl-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[(1R)-1-methyl-3-phenyl-propyl]-3-nitro-benzenesulfonamide CAS Name: 4-fluoro-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide IUPAC Name: 4-fluoro-3-nitro-N-[(2R)-4-phenylbutan-2-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[(1R)-1-methyl-3-phenyl-propyl]-3-nitro-benzenesulfonamide Formula: C16H17FN2O4S MolecularWeight: 352.380583

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H17FN2O4S/c1-12(7-8-13-5-3-2-4-6-13)18-24(22,23)14-9-10-15(17)16(11-14)19(20)21/h2-6,9-12,18H,7-8H2,1H3/t12-/m1/s1