ethyl 2-[7-chloranyl-3-oxidanylidene-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]ethanoate

Systemtic Name: ethyl 2-[7-chloranyl-3-oxidanylidene-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]ethanoate Openeye Name: ethyl 2-[7-chloro-3-oxo-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]acetate CAS Name: 2-[7-chloro-3-oxo-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[7-chloro-3-oxo-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]acetate Traditional Name: 2-[7-chloro-3-keto-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]acetic acid ethyl ester Formula: C13H11ClF3NO3S MolecularWeight: 353.74455

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)CSC2=C1C=C(C(=C2)Cl)C(F)(F)F

Isomeric SMILES

CCOC(=O)CN1C(=O)CSC2=C1C=C(C(=C2)Cl)C(F)(F)F

InChI

InChI=1S/C13H11ClF3NO3S/c1-2-21-12(20)5-18-9-3-7(13(15,16)17)8(14)4-10(9)22-6-11(18)19/h3-4H,2,5-6H2,1H3