ethyl 2-[2-[(5-azanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate

Systemtic Name: ethyl 2-[2-[(5-azanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoate Openeye Name: ethyl 2-[2-(5-amino-2-fluoro-anilino)-2-oxo-ethyl]sulfonylacetate CAS Name: 2-[2-(5-amino-2-fluoroanilino)-2-oxoethyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(5-amino-2-fluoroanilino)-2-oxoethyl]sulfonylacetate Traditional Name: 2-[2-(5-amino-2-fluoro-anilino)-2-keto-ethyl]sulfonylacetic acid ethyl ester Formula: C12H15FN2O5S MolecularWeight: 318.321303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)CC(=O)NC1=C(C=CC(=C1)N)F

Isomeric SMILES

CCOC(=O)CS(=O)(=O)CC(=O)NC1=C(C=CC(=C1)N)F

InChI

InChI=1S/C12H15FN2O5S/c1-2-20-12(17)7-21(18,19)6-11(16)15-10-5-8(14)3-4-9(10)13/h3-5H,2,6-7,14H2,1H3,(H,15,16)