1-[cyano-(6-phenoxypyridin-2-yl)methyl]-3-[(E)-2-fluoranyl-3-oxidanyl-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate

Systemtic Name: 1-[cyano-(6-phenoxypyridin-2-yl)methyl]-3-[(E)-2-fluoranyl-3-oxidanyl-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate Openeye Name: 1-[cyano-(6-phenoxy-2-pyridyl)methyl]-3-[(E)-2-fluoro-3-hydroxy-3-oxo-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 1-[cyano-(6-phenoxy-2-pyridinyl)methyl]-3-[(E)-2-fluoro-3-hydroxy-3-oxoprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylate IUPAC Name: 1-[cyano-(6-phenoxypyridin-2-yl)methyl]-3-[(E)-2-fluoro-3-hydroxy-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 1-[cyano-(6-phenoxy-2-pyridyl)methyl]-3-[(E)-2-fluoro-3-hydroxy-3-keto-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate Formula: C22H18FN2O5- MolecularWeight: 409.387123

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1(C(C#N)C2=NC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])C=C(C(=O)O)F)C

Isomeric SMILES

CC1(C(C1(C(C#N)C2=NC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])/C=C(\C(=O)O)/F)C

InChI

InChI=1S/C22H19FN2O5/c1-21(2)17(11-15(23)19(26)27)22(21,20(28)29)14(12-24)16-9-6-10-18(25-16)30-13-7-4-3-5-8-13/h3-11,14,17H,1-2H3,(H,26,27)(H,28,29)/p-1/b15-11+