2-(2-fluoranyl-3-methanoyl-pyridin-4-yl)-2-phenylmethoxy-butanoate

Systemtic Name: 2-(2-fluoranyl-3-methanoyl-pyridin-4-yl)-2-phenylmethoxy-butanoate Openeye Name: 2-benzyloxy-2-(2-fluoro-3-formyl-4-pyridyl)butanoate CAS Name: 2-(2-fluoro-3-formyl-4-pyridinyl)-2-phenylmethoxybutanoate IUPAC Name: 2-(2-fluoro-3-formylpyridin-4-yl)-2-phenylmethoxybutanoate Traditional Name: 2-benzoxy-2-(2-fluoro-3-formyl-4-pyridyl)butyrate Formula: C17H15FNO4- MolecularWeight: 316.303703

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=NC=C1)F)C=O)(C(=O)[O-])OCC2=CC=CC=C2

Isomeric SMILES

CCC(C1=C(C(=NC=C1)F)C=O)(C(=O)[O-])OCC2=CC=CC=C2

InChI

InChI=1S/C17H16FNO4/c1-2-17(16(21)22,23-11-12-6-4-3-5-7-12)14-8-9-19-15(18)13(14)10-20/h3-10H,2,11H2,1H3,(H,21,22)/p-1