(5-cyano-2-fluoranyl-phenyl)methyl 3-methoxy-2-oxidanyl-benzoate

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 3-methoxy-2-oxidanyl-benzoate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 2-hydroxy-3-methoxy-benzoate CAS Name: 2-hydroxy-3-methoxybenzoic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 2-hydroxy-3-methoxybenzoate Traditional Name: 2-hydroxy-3-methoxy-benzoic acid (5-cyano-2-fluoro-benzyl) ester Formula: C16H12FNO4 MolecularWeight: 301.269183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C(=O)OCC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

COC1=CC=CC(=C1O)C(=O)OCC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C16H12FNO4/c1-21-14-4-2-3-12(15(14)19)16(20)22-9-11-7-10(8-18)5-6-13(11)17/h2-7,19H,9H2,1H3