ethyl 2-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-8-methyl-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-8-methyl-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-[(4-bromo-2-fluoro-phenyl)methyl]-8-methyl-3-oxo-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[4-[(4-bromo-2-fluorophenyl)methyl]-8-methyl-3-oxo-1,4-benzothiazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(4-bromo-2-fluorophenyl)methyl]-8-methyl-3-oxo-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[4-(4-bromo-2-fluoro-benzyl)-3-keto-8-methyl-1,4-benzothiazin-2-yl]acetic acid ethyl ester Formula: C20H19BrFNO3S MolecularWeight: 452.337163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)N(C2=CC=CC(=C2S1)C)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCOC(=O)CC1C(=O)N(C2=CC=CC(=C2S1)C)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H19BrFNO3S/c1-3-26-18(24)10-17-20(25)23(11-13-7-8-14(21)9-15(13)22)16-6-4-5-12(2)19(16)27-17/h4-9,17H,3,10-11H2,1-2H3