ethyl 2-[(3S)-2-tert-butyl-5-fluoranyl-1,1-bis(oxidanylidene)-3H-1,2-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[(3S)-2-tert-butyl-5-fluoranyl-1,1-bis(oxidanylidene)-3H-1,2-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[(3S)-2-tert-butyl-5-fluoro-1,1-dioxo-3H-1,2-benzothiazol-3-yl]acetate CAS Name: 2-[(3S)-2-tert-butyl-5-fluoro-1,1-dioxo-3H-1,2-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3S)-2-tert-butyl-5-fluoro-1,1-dioxo-3H-1,2-benzothiazol-3-yl]acetate Traditional Name: 2-[(3S)-2-tert-butyl-5-fluoro-1,1-diketo-3H-1,2-benzothiazol-3-yl]acetic acid ethyl ester Formula: C15H20FNO4S MolecularWeight: 329.387003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C2=C(C=CC(=C2)F)S(=O)(=O)N1C(C)(C)C

Isomeric SMILES

CCOC(=O)C[C@H]1C2=C(C=CC(=C2)F)S(=O)(=O)N1C(C)(C)C

InChI

InChI=1S/C15H20FNO4S/c1-5-21-14(18)9-12-11-8-10(16)6-7-13(11)22(19,20)17(12)15(2,3)4/h6-8,12H,5,9H2,1-4H3/t12-/m0/s1