ethyl (E)-2-[2-bromanyl-4,5-bis(fluoranyl)phenyl]carbonyl-3-thiophen-2-yl-prop-2-enoate

Systemtic Name: ethyl (E)-2-[2-bromanyl-4,5-bis(fluoranyl)phenyl]carbonyl-3-thiophen-2-yl-prop-2-enoate Openeye Name: ethyl (E)-2-(2-bromo-4,5-difluoro-benzoyl)-3-(2-thienyl)prop-2-enoate CAS Name: (E)-2-[(2-bromo-4,5-difluorophenyl)-oxomethyl]-3-thiophen-2-yl-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-(2-bromo-4,5-difluorobenzoyl)-3-thiophen-2-ylprop-2-enoate Traditional Name: (E)-2-(2-bromo-4,5-difluoro-benzoyl)-3-(2-thienyl)acrylic acid ethyl ester Formula: C16H11BrF2O3S MolecularWeight: 401.222546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CS1)C(=O)C2=CC(=C(C=C2Br)F)F

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=CS1)/C(=O)C2=CC(=C(C=C2Br)F)F

InChI

InChI=1S/C16H11BrF2O3S/c1-2-22-16(21)11(6-9-4-3-5-23-9)15(20)10-7-13(18)14(19)8-12(10)17/h3-8H,2H2,1H3/b11-6+