tert-butyl (E)-3-[3-fluoranyl-4-[(Z)-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]prop-2-enoate

Systemtic Name: tert-butyl (E)-3-[3-fluoranyl-4-[(Z)-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]prop-2-enoate Openeye Name: tert-butyl (E)-3-[3-fluoro-4-[(Z)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]prop-2-enoate CAS Name: (E)-3-[3-fluoro-4-[(Z)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-[3-fluoro-4-[(Z)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-fluoro-4-[(Z)-(3-keto-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]acrylic acid tert-butyl ester Formula: C22H20FNO3S MolecularWeight: 397.462503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC1=CC(=C(C=C1)C=C2C(=O)NC3=CC=CC=C3S2)F

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C1=CC(=C(C=C1)/C=C\2/C(=O)NC3=CC=CC=C3S2)F

InChI

InChI=1S/C22H20FNO3S/c1-22(2,3)27-20(25)11-9-14-8-10-15(16(23)12-14)13-19-21(26)24-17-6-4-5-7-18(17)28-19/h4-13H,1-3H3,(H,24,26)/b11-9+,19-13-