N-[(2,3-dimethoxyphenyl)methyl]-4-fluoranyl-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-4-fluoranyl-N-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-4-fluoro-N-methyl-3-nitro-benzenesulfonamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-4-fluoro-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-4-fluoro-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-fluoro-N-methyl-3-nitro-N-o-veratryl-benzenesulfonamide Formula: C16H17FN2O6S MolecularWeight: 384.379383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17FN2O6S/c1-18(10-11-5-4-6-15(24-2)16(11)25-3)26(22,23)12-7-8-13(17)14(9-12)19(20)21/h4-9H,10H2,1-3H3