sodium [4-fluoranyl-2-(trifluoromethyl)phenyl]carbonyl-pyridin-3-ylsulfonyl-azanide

Systemtic Name: sodium [4-fluoranyl-2-(trifluoromethyl)phenyl]carbonyl-pyridin-3-ylsulfonyl-azanide Openeye Name: sodium [4-fluoro-2-(trifluoromethyl)benzoyl]-(3-pyridylsulfonyl)azanide CAS Name: sodium [[4-fluoro-2-(trifluoromethyl)phenyl]-oxomethyl]-(3-pyridinylsulfonyl)azanide IUPAC Name: sodium [4-fluoro-2-(trifluoromethyl)benzoyl]-pyridin-3-ylsulfonylazanide Traditional Name: sodium [4-fluoro-2-(trifluoromethyl)benzoyl]-(3-pyridylsulfonyl)azanide Formula: C13H7F4N2NaO3S MolecularWeight: 370.254663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)S(=O)(=O)[N-]C(=O)C2=C(C=C(C=C2)F)C(F)(F)F.[Na+]

Isomeric SMILES

C1=CC(=CN=C1)S(=O)(=O)[N-]C(=O)C2=C(C=C(C=C2)F)C(F)(F)F.[Na+]

InChI

InChI=1S/C13H8F4N2O3S.Na/c14-8-3-4-10(11(6-8)13(15,16)17)12(20)19-23(21,22)9-2-1-5-18-7-9;/h1-7H,(H,19,20);/q;+1/p-1