N-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methyl]-4-methoxy-2-nitro-benzenesulfonamide

Systemtic Name: N-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methyl]-4-methoxy-2-nitro-benzenesulfonamide Openeye Name: N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-4-methoxy-2-nitro-benzenesulfonamide CAS Name: N-[[2-(3-fluorophenoxy)-3-pyridinyl]methyl]-4-methoxy-2-nitrobenzenesulfonamide IUPAC Name: N-[[2-(3-fluorophenoxy)pyridin-3-yl]methyl]-4-methoxy-2-nitrobenzenesulfonamide Traditional Name: N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-4-methoxy-2-nitro-benzenesulfonamide Formula: C19H16FN3O6S MolecularWeight: 433.410243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)NCC2=C(N=CC=C2)OC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)NCC2=C(N=CC=C2)OC3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H16FN3O6S/c1-28-15-7-8-18(17(11-15)23(24)25)30(26,27)22-12-13-4-3-9-21-19(13)29-16-6-2-5-14(20)10-16/h2-11,22H,12H2,1H3