N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-fluoro-benzenesulfonamide Formula: C16H17FN2O6S MolecularWeight: 384.379383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNS(=O)(=O)C2=CC=C(C=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C16H17FN2O6S/c1-24-15-9-11(14(19(20)21)10-16(15)25-2)7-8-18-26(22,23)13-5-3-12(17)4-6-13/h3-6,9-10,18H,7-8H2,1-2H3