N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-fluoranyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-fluoranyl-3-nitro-benzenesulfonamide Openeye Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-fluoro-3-nitro-benzenesulfonamide CAS Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-fluoro-3-nitrobenzenesulfonamide IUPAC Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-fluoro-3-nitrobenzenesulfonamide Traditional Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-fluoro-3-nitro-benzenesulfonamide Formula: C16H15FN2O6S MolecularWeight: 382.363503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NS(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCCO2)NS(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H15FN2O6S/c1-10(11-2-5-15-16(8-11)25-7-6-24-15)18-26(22,23)12-3-4-13(17)14(9-12)19(20)21/h2-5,8-10,18H,6-7H2,1H3/t10-/m1/s1