N-cyclopropyl-4-fluoranyl-N-[(4-methoxyphenyl)methyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-fluoranyl-N-[(4-methoxyphenyl)methyl]-3-nitro-benzenesulfonamide Openeye Name: N-cyclopropyl-4-fluoro-N-[(4-methoxyphenyl)methyl]-3-nitro-benzenesulfonamide CAS Name: N-cyclopropyl-4-fluoro-N-[(4-methoxyphenyl)methyl]-3-nitrobenzenesulfonamide IUPAC Name: N-cyclopropyl-4-fluoro-N-[(4-methoxyphenyl)methyl]-3-nitrobenzenesulfonamide Traditional Name: N-cyclopropyl-4-fluoro-3-nitro-N-p-anisyl-benzenesulfonamide Formula: C17H17FN2O5S MolecularWeight: 380.390683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CC2)S(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2CC2)S(=O)(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17FN2O5S/c1-25-14-6-2-12(3-7-14)11-19(13-4-5-13)26(23,24)15-8-9-16(18)17(10-15)20(21)22/h2-3,6-10,13H,4-5,11H2,1H3