4-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylmorpholine Openeye Name: 4-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylmorpholine CAS Name: 4-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylmorpholine Traditional Name: 4-[3-nitro-4-[3-(trifluoromethyl)benzyl]oxy-phenyl]sulfonylmorpholine Formula: C18H17F3N2O6S MolecularWeight: 446.39759

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H17F3N2O6S/c19-18(20,21)14-3-1-2-13(10-14)12-29-17-5-4-15(11-16(17)23(24)25)30(26,27)22-6-8-28-9-7-22/h1-5,10-11H,6-9,12H2