sodium [2,4-bis(trifluoromethyl)phenyl]carbonyl-(6-phenoxypyridin-3-yl)sulfonyl-azanide

Systemtic Name: sodium [2,4-bis(trifluoromethyl)phenyl]carbonyl-(6-phenoxypyridin-3-yl)sulfonyl-azanide Openeye Name: sodium [2,4-bis(trifluoromethyl)benzoyl]-[(6-phenoxy-3-pyridyl)sulfonyl]azanide CAS Name: sodium [[2,4-bis(trifluoromethyl)phenyl]-oxomethyl]-[(6-phenoxy-3-pyridinyl)sulfonyl]azanide IUPAC Name: sodium [2,4-bis(trifluoromethyl)benzoyl]-(6-phenoxypyridin-3-yl)sulfonylazanide Traditional Name: sodium [2,4-bis(trifluoromethyl)benzoyl]-[(6-phenoxy-3-pyridyl)sulfonyl]azanide Formula: C20H11F6N2NaO4S MolecularWeight: 512.357529

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=NC=C(C=C2)S(=O)(=O)[N-]C(=O)C3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)OC2=NC=C(C=C2)S(=O)(=O)[N-]C(=O)C3=C(C=C(C=C3)C(F)(F)F)C(F)(F)F.[Na+]

InChI

InChI=1S/C20H12F6N2O4S.Na/c21-19(22,23)12-6-8-15(16(10-12)20(24,25)26)18(29)28-33(30,31)14-7-9-17(27-11-14)32-13-4-2-1-3-5-13;/h1-11H,(H,28,29);/q;+1/p-1