5-[2-chloranyl-6-cyano-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitro-benzamide

Systemtic Name: 5-[2-chloranyl-6-cyano-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitro-benzamide Openeye Name: 5-[2-chloro-6-cyano-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitro-benzamide CAS Name: 5-[2-chloro-6-cyano-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitrobenzamide IUPAC Name: 5-[2-chloro-6-cyano-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitrobenzamide Traditional Name: 5-[2-chloro-6-cyano-4-(trifluoromethyl)phenoxy]-N-mesyl-2-nitro-benzamide Formula: C16H9ClF3N3O6S MolecularWeight: 463.77237

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2C#N)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2C#N)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H9ClF3N3O6S/c1-30(27,28)22-15(24)11-6-10(2-3-13(11)23(25)26)29-14-8(7-21)4-9(5-12(14)17)16(18,19)20/h2-6H,1H3,(H,22,24)