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

Systemtic Name: sodium 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitro-benzamide Openeye Name: sodium 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitro-benzamide CAS Name: sodium 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitrobenzamide IUPAC Name: sodium 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-methylsulfonyl-2-nitrobenzamide Traditional Name: sodium 5-[2-chloro-4-(trifluoromethyl)phenoxy]-N-mesyl-2-nitro-benzamide Formula: C15H10ClF3N2NaO6S+ MolecularWeight: 461.75268

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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=C2)C(F)(F)F)Cl)[N+](=O)[O-].[Na+]

Isomeric SMILES

CS(=O)(=O)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C15H10ClF3N2O6S.Na/c1-28(25,26)20-14(22)10-7-9(3-4-12(10)21(23)24)27-13-5-2-8(6-11(13)16)15(17,18)19;/h2-7H,1H3,(H,20,22);/q;+1