N-[4-bromanyl-3-(trifluoromethyl)phenyl]-4-methoxy-2-nitro-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-3-(trifluoromethyl)phenyl]-4-methoxy-2-nitro-benzenesulfonamide Openeye Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-methoxy-2-nitro-benzenesulfonamide CAS Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-methoxy-2-nitrobenzenesulfonamide IUPAC Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-methoxy-2-nitrobenzenesulfonamide Traditional Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-methoxy-2-nitro-benzenesulfonamide Formula: C14H10BrF3N2O5S MolecularWeight: 455.20381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10BrF3N2O5S/c1-25-9-3-5-13(12(7-9)20(21)22)26(23,24)19-8-2-4-11(15)10(6-8)14(16,17)18/h2-7,19H,1H3