N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-methyl-3-nitro-benzenesulfonamide Openeye Name: N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-2-methyl-3-nitro-benzenesulfonamide CAS Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-2-methyl-3-nitrobenzenesulfonamide Traditional Name: N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-2-methyl-3-nitro-benzenesulfonamide Formula: C17H19FN2O5S MolecularWeight: 382.406563

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)S(=O)(=O)C2=CC=CC(=C2C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)S(=O)(=O)C2=CC=CC(=C2C)[N+](=O)[O-]

InChI

InChI=1S/C17H19FN2O5S/c1-4-19(11-13-8-9-16(25-3)14(18)10-13)26(23,24)17-7-5-6-15(12(17)2)20(21)22/h5-10H,4,11H2,1-3H3