ethyl 3-cyano-2-(dimethylamino)-5-fluoranyl-benzoate

Systemtic Name: ethyl 3-cyano-2-(dimethylamino)-5-fluoranyl-benzoate Openeye Name: ethyl 3-cyano-2-(dimethylamino)-5-fluoro-benzoate CAS Name: 3-cyano-2-(dimethylamino)-5-fluorobenzoic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-(dimethylamino)-5-fluorobenzoate Traditional Name: 3-cyano-2-(dimethylamino)-5-fluoro-benzoic acid ethyl ester Formula: C12H13FN2O2 MolecularWeight: 236.242223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC(=C1)F)C#N)N(C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC(=C1)F)C#N)N(C)C

InChI

InChI=1S/C12H13FN2O2/c1-4-17-12(16)10-6-9(13)5-8(7-14)11(10)15(2)3/h5-6H,4H2,1-3H3