3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzenecarbonitrile

Systemtic Name: 3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzenecarbonitrile Openeye Name: 3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzonitrile CAS Name: 3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzonitrile IUPAC Name: 3-[2-nitro-4-(trifluoromethylsulfonyl)phenoxy]benzonitrile Traditional Name: 3-(2-nitro-4-triflyl-phenoxy)benzonitrile Formula: C14H7F3N2O5S MolecularWeight: 372.27599

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H7F3N2O5S/c15-14(16,17)25(22,23)11-4-5-13(12(7-11)19(20)21)24-10-3-1-2-9(6-10)8-18/h1-7H