N-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methyl]-2-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methyl]-2-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-2-methyl-3-nitro-benzenesulfonamide CAS Name: N-[[2-(3-fluorophenoxy)-3-pyridinyl]methyl]-2-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[[2-(3-fluorophenoxy)pyridin-3-yl]methyl]-2-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-2-methyl-3-nitro-benzenesulfonamide Formula: C19H16FN3O5S MolecularWeight: 417.410843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NCC2=C(N=CC=C2)OC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NCC2=C(N=CC=C2)OC3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H16FN3O5S/c1-13-17(23(24)25)8-3-9-18(13)29(26,27)22-12-14-5-4-10-21-19(14)28-16-7-2-6-15(20)11-16/h2-11,22H,12H2,1H3