[1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-but-2-enoate

Systemtic Name: [1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-but-2-enoate Openeye Name: [2-(4-bromo-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-(4-bromo-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C13H13BrFNO3 MolecularWeight: 330.149623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OC(C)C(=O)NC1=C(C=C(C=C1)Br)F

Isomeric SMILES

C/C=C/C(=O)OC(C)C(=O)NC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C13H13BrFNO3/c1-3-4-12(17)19-8(2)13(18)16-11-6-5-9(14)7-10(11)15/h3-8H,1-2H3,(H,16,18)/b4-3+