N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N,4-dimethyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N,4-dimethyl-3-nitro-benzenesulfonamide Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-N,4-dimethyl-3-nitro-benzenesulfonamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N,4-dimethyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N,4-dimethyl-3-nitrobenzenesulfonamide Traditional Name: N-(3-fluoro-4-methoxy-benzyl)-N,4-dimethyl-3-nitro-benzenesulfonamide Formula: C16H17FN2O5S MolecularWeight: 368.379983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC2=CC(=C(C=C2)OC)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC2=CC(=C(C=C2)OC)F)[N+](=O)[O-]

InChI

InChI=1S/C16H17FN2O5S/c1-11-4-6-13(9-15(11)19(20)21)25(22,23)18(2)10-12-5-7-16(24-3)14(17)8-12/h4-9H,10H2,1-3H3