ethyl 2-(5-azanyl-4-fluoranyl-2-thiocyanato-phenyl)-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-(5-azanyl-4-fluoranyl-2-thiocyanato-phenyl)-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-(5-amino-4-fluoro-2-thiocyanato-phenyl)-2-oxo-acetate CAS Name: 2-(5-amino-4-fluoro-2-thiocyanatophenyl)-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-(5-amino-4-fluoro-2-thiocyanatophenyl)-2-oxoacetate Traditional Name: 2-(5-amino-4-fluoro-2-thiocyanato-phenyl)-2-keto-acetic acid ethyl ester Formula: C11H9FN2O3S MolecularWeight: 268.264163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=CC(=C(C=C1SC#N)F)N

Isomeric SMILES

CCOC(=O)C(=O)C1=CC(=C(C=C1SC#N)F)N

InChI

InChI=1S/C11H9FN2O3S/c1-2-17-11(16)10(15)6-3-8(14)7(12)4-9(6)18-5-13/h3-4H,2,14H2,1H3