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

Systemtic Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-4-fluoranyl-3-nitro-benzenesulfonamide Openeye Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-4-fluoro-3-nitro-benzenesulfonamide CAS Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-4-fluoro-3-nitrobenzenesulfonamide IUPAC Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-4-fluoro-3-nitrobenzenesulfonamide Traditional Name: N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-4-fluoro-3-nitro-benzenesulfonamide Formula: C18H19FN2O6S MolecularWeight: 410.416663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19FN2O6S/c1-11(2)18(12-3-6-16-17(9-12)27-8-7-26-16)20-28(24,25)13-4-5-14(19)15(10-13)21(22)23/h3-6,9-11,18,20H,7-8H2,1-2H3/t18-/m1/s1